3-methyl-N-(4-methyl-2-morpholin-4-yl-quinolin-6-yl)-4-(3-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: 3-methyl-N-(4-methyl-2-morpholin-4-yl-quinolin-6-yl)-4-(3-methylphenyl)piperazine-1-carbothioamide Openeye Name: 3-methyl-N-(4-methyl-2-morpholino-6-quinolyl)-4-(m-tolyl)piperazine-1-carbothioamide CAS Name: 3-methyl-N-[4-methyl-2-(4-morpholinyl)-6-quinolinyl]-4-(3-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 3-methyl-N-(4-methyl-2-morpholin-4-ylquinolin-6-yl)-4-(3-methylphenyl)piperazine-1-carbothioamide Traditional Name: 3-methyl-N-(4-methyl-2-morpholino-6-quinolyl)-4-(m-tolyl)piperazine-1-carbothioamide Formula: C27H33N5OS MolecularWeight: 475.64882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=S)NC3=CC4=C(C=C3)N=C(C=C4C)N5CCOCC5

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=S)NC3=CC4=C(C=C3)N=C(C=C4C)N5CCOCC5

InChI

InChI=1S/C27H33N5OS/c1-19-5-4-6-23(15-19)32-10-9-31(18-21(32)3)27(34)28-22-7-8-25-24(17-22)20(2)16-26(29-25)30-11-13-33-14-12-30/h4-8,15-17,21H,9-14,18H2,1-3H3,(H,28,34)