1-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-3-propan-2-yl-thiourea

Systemtic Name: 1-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]thiourea CAS Name: 1-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]-3-propan-2-ylthiourea IUPAC Name: 1-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]thiourea Formula: C19H27N5S MolecularWeight: 357.51618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)NC(C)C)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)NC(C)C)N3CCN(CC3)C

InChI

InChI=1S/C19H27N5S/c1-13(2)20-19(25)21-15-5-6-17-16(12-15)14(3)11-18(22-17)24-9-7-23(4)8-10-24/h5-6,11-13H,7-10H2,1-4H3,(H2,20,21,25)