4-[(3-chlorophenyl)amino]quinoline-3-carbothioamide

Systemtic Name: 4-[(3-chlorophenyl)amino]quinoline-3-carbothioamide Openeye Name: 4-(3-chloroanilino)quinoline-3-carbothioamide CAS Name: 4-(3-chloroanilino)-3-quinolinecarbothioamide IUPAC Name: 4-(3-chloroanilino)quinoline-3-carbothioamide Traditional Name: 4-(3-chloroanilino)quinoline-3-carbothioamide Formula: C16H12ClN3S MolecularWeight: 313.80458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C(=S)N)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C(=S)N)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H12ClN3S/c17-10-4-3-5-11(8-10)20-15-12-6-1-2-7-14(12)19-9-13(15)16(18)21/h1-9H,(H2,18,21)(H,19,20)