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

Systemtic Name: 1-(2-dimethylaminoethyl)-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea Openeye Name: 1-(2-dimethylaminoethyl)-3-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]thiourea CAS Name: 1-(2-dimethylaminoethyl)-3-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]thiourea IUPAC Name: 1-(2-dimethylaminoethyl)-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]thiourea Traditional Name: 1-(2-dimethylaminoethyl)-3-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]thiourea Formula: C20H30N6S MolecularWeight: 386.5574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N6S/c1-15-13-19(26-11-9-25(4)10-12-26)23-18-6-5-16(14-17(15)18)22-20(27)21-7-8-24(2)3/h5-6,13-14H,7-12H2,1-4H3,(H2,21,22,27)