N-[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[(3-chloro-4-pyrrolidin-1-yl-phenyl)carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[3-chloro-4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[(3-chloro-4-pyrrolidino-phenyl)thiocarbamoyl]thiophene-2-carboxamide Formula: C16H16ClN3OS2 MolecularWeight: 365.90074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CS3)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C16H16ClN3OS2/c17-12-10-11(5-6-13(12)20-7-1-2-8-20)18-16(22)19-15(21)14-4-3-9-23-14/h3-6,9-10H,1-2,7-8H2,(H2,18,19,21,22)