2-methylpropyl N-[1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]amino]-1,2-bis(oxidanylidene)hexan-3-yl]carbamoyl]-4-(phenylmethylsulfanyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: 2-methylpropyl N-[1-cyclohexyl-2-[2-[[1-[[2-[[2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]amino]-1,2-bis(oxidanylidene)hexan-3-yl]carbamoyl]-4-(phenylmethylsulfanyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]carbamate Openeye Name: isobutyl N-[2-[4-benzylsulfanyl-2-[1-[2-[[2-[[2-(dimethylamino)-2-oxo-1-phenyl-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-acetyl]butylcarbamoyl]pyrrolidin-1-yl]-1-cyclohexyl-2-oxo-ethyl]carbamate CAS Name: N-[1-cyclohexyl-2-[2-[[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]amino]-oxomethyl]-4-(phenylmethylthio)-1-pyrrolidinyl]-2-oxoethyl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[2-[4-benzylsulfanyl-2-[[1-[[2-[[2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]carbamoyl]pyrrolidin-1-yl]-1-cyclohexyl-2-oxoethyl]carbamate Traditional Name: N-[2-[4-(benzylthio)-2-[1-[2-[[2-[[2-(dimethylamino)-2-keto-1-phenyl-ethyl]amino]-2-keto-ethyl]amino]-2-keto-acetyl]butylcarbamoyl]pyrrolidino]-1-cyclohexyl-2-keto-ethyl]carbamic acid isobutyl ester Formula: C43H60N6O8S MolecularWeight: 821.0369

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N(C)C)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)OCC(C)C)SCC4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N(C)C)NC(=O)C2CC(CN2C(=O)C(C3CCCCC3)NC(=O)OCC(C)C)SCC4=CC=CC=C4

InChI

InChI=1S/C43H60N6O8S/c1-6-16-33(38(51)40(53)44-24-35(50)46-36(41(54)48(4)5)30-19-12-8-13-20-30)45-39(52)34-23-32(58-27-29-17-10-7-11-18-29)25-49(34)42(55)37(31-21-14-9-15-22-31)47-43(56)57-26-28(2)3/h7-8,10-13,17-20,28,31-34,36-37H,6,9,14-16,21-27H2,1-5H3,(H,44,53)(H,45,52)(H,46,50)(H,47,56)