ethyl 3-[[5-methyl-2-[(1S)-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-1,3-oxazol-4-yl]carbonylamino]-3-oxidanylidene-2-[1-(phenylsulfonyl)indol-3-yl]propanoate

Systemtic Name: ethyl 3-[[5-methyl-2-[(1S)-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-1,3-oxazol-4-yl]carbonylamino]-3-oxidanylidene-2-[1-(phenylsulfonyl)indol-3-yl]propanoate Openeye Name: ethyl 2-[1-(benzenesulfonyl)indol-3-yl]-3-[[2-[(1S)-1-(tert-butoxycarbonylamino)-2-methyl-propyl]-5-methyl-oxazole-4-carbonyl]amino]-3-oxo-propanoate CAS Name: 2-[1-(benzenesulfonyl)-3-indolyl]-3-[[[5-methyl-2-[(1S)-2-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]-4-oxazolyl]-oxomethyl]amino]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-[1-(benzenesulfonyl)indol-3-yl]-3-[[5-methyl-2-[(1S)-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-1,3-oxazole-4-carbonyl]amino]-3-oxopropanoate Traditional Name: 2-(1-besylindol-3-yl)-3-[[2-[(1S)-1-(tert-butoxycarbonylamino)-2-methyl-propyl]-5-methyl-oxazole-4-carbonyl]amino]-3-keto-propionic acid ethyl ester Formula: C33H38N4O9S MolecularWeight: 666.74122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)C(=O)NC(=O)C4=C(OC(=N4)C(C(C)C)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C(C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)C(=O)NC(=O)C4=C(OC(=N4)[C@H](C(C)C)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C33H38N4O9S/c1-8-44-31(40)25(23-18-37(24-17-13-12-16-22(23)24)47(42,43)21-14-10-9-11-15-21)28(38)36-29(39)27-20(4)45-30(34-27)26(19(2)3)35-32(41)46-33(5,6)7/h9-19,25-26H,8H2,1-7H3,(H,35,41)(H,36,38,39)/t25?,26-/m0/s1