[(E)-[2-[(4-chlorophenyl)methylsulfanyl]quinolin-3-yl]methylideneamino] cyclopropanecarboxylate

Systemtic Name: [(E)-[2-[(4-chlorophenyl)methylsulfanyl]quinolin-3-yl]methylideneamino] cyclopropanecarboxylate Openeye Name: [(E)-[2-[(4-chlorophenyl)methylsulfanyl]-3-quinolyl]methyleneamino] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [(E)-[2-[(4-chlorophenyl)methylthio]-3-quinolinyl]methylideneamino] ester IUPAC Name: [(E)-[2-[(4-chlorophenyl)methylsulfanyl]quinolin-3-yl]methylideneamino] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [(E)-[2-[(4-chlorobenzyl)thio]-3-quinolyl]methyleneamino] ester Formula: C21H17ClN2O2S MolecularWeight: 396.88988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)ON=CC2=CC3=CC=CC=C3N=C2SCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC1C(=O)O/N=C/C2=CC3=CC=CC=C3N=C2SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN2O2S/c22-18-9-5-14(6-10-18)13-27-20-17(12-23-26-21(25)15-7-8-15)11-16-3-1-2-4-19(16)24-20/h1-6,9-12,15H,7-8,13H2/b23-12+