N-[1-azanyl-3-(cyclohexylmethylsulfanyl)-1-oxidanylidene-propan-2-yl]-3-[(4-methoxy-3-oxidanyl-phenyl)methyl]-1,3-thiazolidine-4-carboxamide

Systemtic Name: N-[1-azanyl-3-(cyclohexylmethylsulfanyl)-1-oxidanylidene-propan-2-yl]-3-[(4-methoxy-3-oxidanyl-phenyl)methyl]-1,3-thiazolidine-4-carboxamide Openeye Name: N-[2-amino-1-(cyclohexylmethylsulfanylmethyl)-2-oxo-ethyl]-3-[(3-hydroxy-4-methoxy-phenyl)methyl]thiazolidine-4-carboxamide CAS Name: N-[1-amino-3-(cyclohexylmethylthio)-1-oxopropan-2-yl]-3-[(3-hydroxy-4-methoxyphenyl)methyl]-4-thiazolidinecarboxamide IUPAC Name: N-[1-amino-3-(cyclohexylmethylsulfanyl)-1-oxopropan-2-yl]-3-[(3-hydroxy-4-methoxyphenyl)methyl]-1,3-thiazolidine-4-carboxamide Traditional Name: N-[2-amino-1-[(cyclohexylmethylthio)methyl]-2-keto-ethyl]-3-(3-hydroxy-4-methoxy-benzyl)thiazolidine-4-carboxamide Formula: C22H33N3O4S2 MolecularWeight: 467.64512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CSCC2C(=O)NC(CSCC3CCCCC3)C(=O)N)O

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CSCC2C(=O)NC(CSCC3CCCCC3)C(=O)N)O

InChI

InChI=1S/C22H33N3O4S2/c1-29-20-8-7-16(9-19(20)26)10-25-14-31-13-18(25)22(28)24-17(21(23)27)12-30-11-15-5-3-2-4-6-15/h7-9,15,17-18,26H,2-6,10-14H2,1H3,(H2,23,27)(H,24,28)