N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C20H20ClN3OS/c21-16-9-6-10-17(19(16)24-13-4-5-14-24)22-20(26)23-18(25)12-11-15-7-2-1-3-8-15/h1-3,6-12H,4-5,13-14H2,(H2,22,23,25,26)