N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethyl-benzamide Openeye Name: N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethyl-benzamide CAS Name: N-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3,5-dimethylbenzamide IUPAC Name: N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3,5-dimethylbenzamide Traditional Name: N-[(6-methoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-3,5-dimethyl-benzamide Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)OC)C

InChI

InChI=1S/C18H17N3O2S2/c1-10-6-11(2)8-12(7-10)16(22)20-17(24)21-18-19-14-5-4-13(23-3)9-15(14)25-18/h4-9H,1-3H3,(H2,19,20,21,22,24)