N-(1,3-benzothiazol-2-ylcarbamothioyl)-3,4-dimethyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-3,4-dimethyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-3,4-dimethyl-benzamide CAS Name: N-[(1,3-benzothiazol-2-ylamino)-sulfanylidenemethyl]-3,4-dimethylbenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-3,4-dimethylbenzamide Traditional Name: N-(1,3-benzothiazol-2-ylthiocarbamoyl)-3,4-dimethyl-benzamide Formula: C17H15N3OS2 MolecularWeight: 341.4505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C17H15N3OS2/c1-10-7-8-12(9-11(10)2)15(21)19-16(22)20-17-18-13-5-3-4-6-14(13)23-17/h3-9H,1-2H3,(H2,18,19,20,21,22)