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

Systemtic Name: 1-(3-methoxypropyl)-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea Openeye Name: 1-(3-methoxypropyl)-3-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]thiourea CAS Name: 1-(3-methoxypropyl)-3-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]thiourea IUPAC Name: 1-(3-methoxypropyl)-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea Traditional Name: 1-(3-methoxypropyl)-3-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]thiourea Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N5OS/c1-15-13-19(25-10-8-24(2)9-11-25)23-18-6-5-16(14-17(15)18)22-20(27)21-7-4-12-26-3/h5-6,13-14H,4,7-12H2,1-3H3,(H2,21,22,27)