3-[2-azanyl-3-[(4-methoxyphenyl)methylsulfanyl]-3-methyl-butanoyl]-1,3-thiazolidine-4-carbonitrile hydrochloride

Systemtic Name: 3-[2-azanyl-3-[(4-methoxyphenyl)methylsulfanyl]-3-methyl-butanoyl]-1,3-thiazolidine-4-carbonitrile hydrochloride Openeye Name: 3-[2-amino-3-[(4-methoxyphenyl)methylsulfanyl]-3-methyl-butanoyl]thiazolidine-4-carbonitrile hydrochloride CAS Name: 3-[2-amino-3-[(4-methoxyphenyl)methylthio]-3-methyl-1-oxobutyl]-4-thiazolidinecarbonitrile hydrochloride IUPAC Name: 3-[2-amino-3-[(4-methoxyphenyl)methylsulfanyl]-3-methylbutanoyl]-1,3-thiazolidine-4-carbonitrile hydrochloride Traditional Name: 3-[2-amino-3-methyl-3-(p-anisylthio)butanoyl]thiazolidine-4-carbonitrile hydrochloride Formula: C17H24ClN3O2S2 MolecularWeight: 401.97436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)N1CSCC1C#N)N)SCC2=CC=C(C=C2)OC.Cl

Isomeric SMILES

CC(C)(C(C(=O)N1CSCC1C#N)N)SCC2=CC=C(C=C2)OC.Cl

InChI

InChI=1S/C17H23N3O2S2.ClH/c1-17(2,24-9-12-4-6-14(22-3)7-5-12)15(19)16(21)20-11-23-10-13(20)8-18;/h4-7,13,15H,9-11,19H2,1-3H3;1H