5-(1,3-benzothiazol-2-yl)-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]thiophene-2-carboxamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-thiophene-2-carboxamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CC=C(S2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H19N3O2S2/c1-14-7-9-15(10-8-14)23-20(26)13-25(2)22(27)19-12-11-18(28-19)21-24-16-5-3-4-6-17(16)29-21/h3-12H,13H2,1-2H3,(H,23,26)