2-chloranyl-7-methylsulfanyl-3-[(4-phenylpiperazin-1-yl)methyl]quinoline

Systemtic Name: 2-chloranyl-7-methylsulfanyl-3-[(4-phenylpiperazin-1-yl)methyl]quinoline Openeye Name: 2-chloro-7-methylsulfanyl-3-[(4-phenylpiperazin-1-yl)methyl]quinoline CAS Name: 2-chloro-7-(methylthio)-3-[(4-phenyl-1-piperazinyl)methyl]quinoline IUPAC Name: 2-chloro-7-methylsulfanyl-3-[(4-phenylpiperazin-1-yl)methyl]quinoline Traditional Name: 2-chloro-7-(methylthio)-3-[(4-phenylpiperazino)methyl]quinoline Formula: C21H22ClN3S MolecularWeight: 383.93748

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)CN3CCN(CC3)C4=CC=CC=C4)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)CN3CCN(CC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H22ClN3S/c1-26-19-8-7-16-13-17(21(22)23-20(16)14-19)15-24-9-11-25(12-10-24)18-5-3-2-4-6-18/h2-8,13-14H,9-12,15H2,1H3