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

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide Openeye Name: N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-3-(2-furyl)prop-2-enamide CAS Name: N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-3-(2-furanyl)-2-propenamide IUPAC Name: N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide Traditional Name: N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]-3-(2-furyl)acrylamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=CO3

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=CO3

InChI

InChI=1S/C18H18ClN3O2S/c19-14-6-3-7-15(17(14)22-10-1-2-11-22)20-18(25)21-16(23)9-8-13-5-4-12-24-13/h3-9,12H,1-2,10-11H2,(H2,20,21,23,25)