N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]-3-phenyl-prop-2-enamide CAS Name: N-[[[4-(1,3-benzothiazol-2-yl)phenyl]methylamino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methylcarbamothioyl]-3-phenylprop-2-enamide Traditional Name: N-[[4-(1,3-benzothiazol-2-yl)benzyl]thiocarbamoyl]-3-phenyl-acrylamide Formula: C24H19N3OS2 MolecularWeight: 429.55716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(=S)NCC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)C=CC(=O)NC(=S)NCC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H19N3OS2/c28-22(15-12-17-6-2-1-3-7-17)27-24(29)25-16-18-10-13-19(14-11-18)23-26-20-8-4-5-9-21(20)30-23/h1-15H,16H2,(H2,25,27,28,29)