ethyl (E)-4-[[(2S)-3,3-dimethyl-2-[[(2S)-3-methyl-3-(1-methylindol-3-yl)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butanoyl]amino]butanoyl]-methyl-amino]-2-methyl-but-2-enoate

Systemtic Name: ethyl (E)-4-[[(2S)-3,3-dimethyl-2-[[(2S)-3-methyl-3-(1-methylindol-3-yl)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butanoyl]amino]butanoyl]-methyl-amino]-2-methyl-but-2-enoate Openeye Name: ethyl (E)-4-[[(2S)-2-[[(2S)-2-[tert-butoxycarbonyl(methyl)amino]-3-methyl-3-(1-methylindol-3-yl)butanoyl]amino]-3,3-dimethyl-butanoyl]-methyl-amino]-2-methyl-but-2-enoate CAS Name: (E)-4-[[(2S)-3,3-dimethyl-2-[[(2S)-3-methyl-3-(1-methyl-3-indolyl)-2-[methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]-1-oxobutyl]-methylamino]-2-methyl-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[[(2S)-3,3-dimethyl-2-[[(2S)-3-methyl-3-(1-methylindol-3-yl)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butanoyl]amino]butanoyl]-methylamino]-2-methylbut-2-enoate Traditional Name: (E)-4-[[(2S)-2-[[(2S)-2-[tert-butoxycarbonyl(methyl)amino]-3-methyl-3-(1-methylindol-3-yl)butanoyl]amino]-3,3-dimethyl-butanoyl]-methyl-amino]-2-methyl-but-2-enoic acid ethyl ester Formula: C34H52N4O6 MolecularWeight: 612.79988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CCN(C)C(=O)C(C(C)(C)C)NC(=O)C(C(C)(C)C1=CN(C2=CC=CC=C21)C)N(C)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)/C(=C/CN(C)C(=O)[C@H](C(C)(C)C)NC(=O)[C@H](C(C)(C)C1=CN(C2=CC=CC=C21)C)N(C)C(=O)OC(C)(C)C)/C

InChI

InChI=1S/C34H52N4O6/c1-14-43-30(41)22(2)19-20-36(11)29(40)26(32(3,4)5)35-28(39)27(38(13)31(42)44-33(6,7)8)34(9,10)24-21-37(12)25-18-16-15-17-23(24)25/h15-19,21,26-27H,14,20H2,1-13H3,(H,35,39)/b22-19+/t26-,27-/m1/s1