(E)-N-[(6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[(6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[[(6-methyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(6-methyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C22H17N3O2S2 MolecularWeight: 419.51928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)/C=C/C3=CC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2S2/c1-14-7-10-17-19(13-14)29-22(23-17)25-21(28)24-20(26)12-9-16-8-11-18(27-16)15-5-3-2-4-6-15/h2-13H,1H3,(H2,23,24,25,26,28)/b12-9+