N-[2-[2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide

Systemtic Name: N-[2-[2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide Openeye Name: N-[2-[2-(N-methylanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide CAS Name: N-[2-[[2-(N-methylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-2-thiophenecarboxamide IUPAC Name: N-[2-[2-(N-methylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]thiophene-2-carboxamide Traditional Name: N-[2-[[2-keto-2-(N-methylanilino)ethyl]thio]-1,3-benzothiazol-6-yl]thiophene-2-carboxamide Formula: C21H17N3O2S3 MolecularWeight: 439.57358

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H17N3O2S3/c1-24(15-6-3-2-4-7-15)19(25)13-28-21-23-16-10-9-14(12-18(16)29-21)22-20(26)17-8-5-11-27-17/h2-12H,13H2,1H3,(H,22,26)