(E)-N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[(6-methoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-3-(4-methoxyphenyl)acrylamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C19H17N3O3S2/c1-24-13-6-3-12(4-7-13)5-10-17(23)21-18(26)22-19-20-15-9-8-14(25-2)11-16(15)27-19/h3-11H,1-2H3,(H2,20,21,22,23,26)/b10-5+