N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enamide

Systemtic Name: N-[(3-chloranyl-2-pyrrolidin-1-yl-phenyl)carbamothioyl]-3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enamide Openeye Name: 3-[5-(4-chlorophenyl)-2-furyl]-N-[(3-chloro-2-pyrrolidin-1-yl-phenyl)carbamothioyl]prop-2-enamide CAS Name: 3-[5-(4-chlorophenyl)-2-furanyl]-N-[[3-chloro-2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-[5-(4-chlorophenyl)furan-2-yl]-N-[(3-chloro-2-pyrrolidin-1-ylphenyl)carbamothioyl]prop-2-enamide Traditional Name: 3-[5-(4-chlorophenyl)-2-furyl]-N-[(3-chloro-2-pyrrolidino-phenyl)thiocarbamoyl]acrylamide Formula: C24H21Cl2N3O2S MolecularWeight: 486.41344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H21Cl2N3O2S/c25-17-8-6-16(7-9-17)21-12-10-18(31-21)11-13-22(30)28-24(32)27-20-5-3-4-19(26)23(20)29-14-1-2-15-29/h3-13H,1-2,14-15H2,(H2,27,28,30,32)