[(1S)-1-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethyl] ethanoate

Systemtic Name: [(1S)-1-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethyl] ethanoate Openeye Name: [(1S)-1-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]-2-[1-(p-tolylsulfonyl)indol-3-yl]ethyl] acetate CAS Name: acetic acid [(1S)-1-[[(2S)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-2-[1-(4-methylphenyl)sulfonyl-3-indolyl]ethyl] ester IUPAC Name: [(1S)-1-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-2-[1-(4-methylphenyl)sulfonylindol-3-yl]ethyl] acetate Traditional Name: acetic acid [(1S)-1-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]-2-(1-tosylindol-3-yl)ethyl] ester Formula: C30H39N3O7S MolecularWeight: 585.71156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC(NC(=O)C(CC(C)C)NC(=O)OC(C)(C)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)OC(=O)C

InChI

InChI=1S/C30H39N3O7S/c1-19(2)16-25(31-29(36)40-30(5,6)7)28(35)32-27(39-21(4)34)17-22-18-33(26-11-9-8-10-24(22)26)41(37,38)23-14-12-20(3)13-15-23/h8-15,18-19,25,27H,16-17H2,1-7H3,(H,31,36)(H,32,35)/t25-,27-/m0/s1