(E)-N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide Openeye Name: (E)-N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(2-furyl)prop-2-enamide CAS Name: (E)-N-[[(6-butyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-3-(2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide Traditional Name: (E)-N-[(6-butyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-3-(2-furyl)acrylamide Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C=CC3=CC=CO3

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)/C=C/C3=CC=CO3

InChI

InChI=1S/C19H19N3O2S2/c1-2-3-5-13-7-9-15-16(12-13)26-19(20-15)22-18(25)21-17(23)10-8-14-6-4-11-24-14/h4,6-12H,2-3,5H2,1H3,(H2,20,21,22,23,25)/b10-8+