3,4-bis(chloranyl)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 3,4-bis(chloranyl)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 3,4-dichloro-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide CAS Name: 3,4-dichloro-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4-dichloro-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3,4-dichloro-N-[(2-pyrrolidinophenyl)thiocarbamoyl]benzamide Formula: C18H17Cl2N3OS MolecularWeight: 394.31808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H17Cl2N3OS/c19-13-8-7-12(11-14(13)20)17(24)22-18(25)21-15-5-1-2-6-16(15)23-9-3-4-10-23/h1-2,5-8,11H,3-4,9-10H2,(H2,21,22,24,25)