N-[2-[(4-methylphenyl)carbonylamino]ethyl]-3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide

Systemtic Name: N-[2-[(4-methylphenyl)carbonylamino]ethyl]-3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide Openeye Name: N-[2-[(4-methylbenzoyl)amino]ethyl]-3,5-bis(methylsulfanyl)isothiazole-4-carboxamide CAS Name: N-[2-[[(4-methylphenyl)-oxomethyl]amino]ethyl]-3,5-bis(methylthio)-4-isothiazolecarboxamide IUPAC Name: N-[2-[(4-methylbenzoyl)amino]ethyl]-3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide Traditional Name: 3,5-bis(methylthio)-N-[2-(p-toluoylamino)ethyl]isothiazole-4-carboxamide Formula: C16H19N3O2S3 MolecularWeight: 381.53596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCCNC(=O)C2=C(SN=C2SC)SC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCCNC(=O)C2=C(SN=C2SC)SC

InChI

InChI=1S/C16H19N3O2S3/c1-10-4-6-11(7-5-10)13(20)17-8-9-18-14(21)12-15(22-2)19-24-16(12)23-3/h4-7H,8-9H2,1-3H3,(H,17,20)(H,18,21)