methyl 2-[(2S)-1-[(2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]butanoyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[(2S)-1-[(2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]butanoyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[(2S)-1-[(2S)-2-[[(2S,3S)-2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-butanoyl]pyrrolidin-2-yl]thiazole-4-carboxylate CAS Name: 2-[(2S)-1-[(2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-1-oxobutyl]-2-pyrrolidinyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2S)-1-[(2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]butanoyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(2S)-1-[(2S)-2-[[(2S,3S)-2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-butanoyl]pyrrolidin-2-yl]thiazole-4-carboxylic acid methyl ester Formula: C25H40N4O6S MolecularWeight: 524.6733

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)C)C(=O)N1CCCC1C2=NC(=CS2)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C2=NC(=CS2)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H40N4O6S/c1-9-15(4)19(28-24(33)35-25(5,6)7)20(30)27-18(14(2)3)22(31)29-12-10-11-17(29)21-26-16(13-36-21)23(32)34-8/h13-15,17-19H,9-12H2,1-8H3,(H,27,30)(H,28,33)/t15-,17-,18-,19-/m0/s1