N-[[1-[(2S)-2-azanyl-3-methyl-butanoyl]piperidin-4-yl]-phenyl-methyl]-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine-2-carboxamide

Systemtic Name: N-[[1-[(2S)-2-azanyl-3-methyl-butanoyl]piperidin-4-yl]-phenyl-methyl]-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine-2-carboxamide Openeye Name: N-[[1-[(2S)-2-amino-3-methyl-butanoyl]-4-piperidyl]-phenyl-methyl]-3-(4-phenylphenyl)sulfonyl-thiazolidine-2-carboxamide CAS Name: N-[[1-[(2S)-2-amino-3-methyl-1-oxobutyl]-4-piperidinyl]-phenylmethyl]-3-(4-phenylphenyl)sulfonyl-2-thiazolidinecarboxamide IUPAC Name: N-[[1-[(2S)-2-amino-3-methylbutanoyl]piperidin-4-yl]-phenylmethyl]-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine-2-carboxamide Traditional Name: N-[[1-[(2S)-2-amino-3-methyl-butanoyl]-4-piperidyl]-phenyl-methyl]-3-(4-phenylphenyl)sulfonyl-thiazolidine-2-carboxamide Formula: C33H40N4O4S2 MolecularWeight: 620.8251

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C(C2=CC=CC=C2)NC(=O)C3N(CCS3)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5)N

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)C(C2=CC=CC=C2)NC(=O)C3N(CCS3)S(=O)(=O)C4=CC=C(C=C4)C5=CC=CC=C5)N

InChI

InChI=1S/C33H40N4O4S2/c1-23(2)29(34)32(39)36-19-17-27(18-20-36)30(26-11-7-4-8-12-26)35-31(38)33-37(21-22-42-33)43(40,41)28-15-13-25(14-16-28)24-9-5-3-6-10-24/h3-16,23,27,29-30,33H,17-22,34H2,1-2H3,(H,35,38)/t29-,30?,33?/m0/s1