(2R)-2-azanyl-3-[[(2R)-2-azanyl-3-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-3-oxidanylidene-propyl]disulfanyl]-1-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one

Systemtic Name: (2R)-2-azanyl-3-[[(2R)-2-azanyl-3-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-3-oxidanylidene-propyl]disulfanyl]-1-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one Openeye Name: (2R)-2-amino-3-[[(2R)-2-amino-3-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-3-oxo-propyl]disulfanyl]-1-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one CAS Name: (2R)-2-amino-3-[[(2R)-2-amino-3-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-3-oxopropyl]disulfanyl]-1-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-1-propanone IUPAC Name: (2R)-2-amino-3-[[(2R)-2-amino-3-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-3-oxopropyl]disulfanyl]-1-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one Traditional Name: (2R)-2-amino-3-[[(2R)-2-amino-3-keto-3-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propyl]disulfanyl]-1-[(8S)-8-[(4-methoxycyclohexyl)methyl]-2-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one Formula: C48H66N8O6S2 MolecularWeight: 915.21764

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1)CC2C3=NC(=CN3CCN2C(=O)C(CSSCC(C(=O)N4CCN5C=C(N=C5C4CC6CCC(CC6)OC)C7=CC=CC=C7OC)N)N)C8=CC=CC=C8OC

Isomeric SMILES

COC1CCC(CC1)C[C@H]2C3=NC(=CN3CCN2C(=O)[C@H](CSSC[C@@H](C(=O)N4CCN5C=C(N=C5[C@@H]4CC6CCC(CC6)OC)C7=CC=CC=C7OC)N)N)C8=CC=CC=C8OC

InChI

InChI=1S/C48H66N8O6S2/c1-59-33-17-13-31(14-18-33)25-41-45-51-39(35-9-5-7-11-43(35)61-3)27-53(45)21-23-55(41)47(57)37(49)29-63-64-30-38(50)48(58)56-24-22-54-28-40(36-10-6-8-12-44(36)62-4)52-46(54)42(56)26-32-15-19-34(60-2)20-16-32/h5-12,27-28,31-34,37-38,41-42H,13-26,29-30,49-50H2,1-4H3/t31?,32?,33?,34?,37-,38-,41-,42-/m0/s1