(E)-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(3-chloro-4-piperidino-phenyl)thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=C(O3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H24ClN3O2S/c26-21-17-19(9-12-22(21)29-15-5-2-6-16-29)27-25(32)28-24(30)14-11-20-10-13-23(31-20)18-7-3-1-4-8-18/h1,3-4,7-14,17H,2,5-6,15-16H2,(H2,27,28,30,32)/b14-11+