(E)-3-phenyl-N-[[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-phenyl-N-[[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-N-[[4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]anilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-3-phenyl-N-[[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-phenyl-N-[[4-[4-(2-thenoyl)piperazino]phenyl]thiocarbamoyl]acrylamide Formula: C25H24N4O2S2 MolecularWeight: 476.61366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H24N4O2S2/c30-23(13-8-19-5-2-1-3-6-19)27-25(32)26-20-9-11-21(12-10-20)28-14-16-29(17-15-28)24(31)22-7-4-18-33-22/h1-13,18H,14-17H2,(H2,26,27,30,32)/b13-8+