1-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-3-thiophen-2-yl-urea

Systemtic Name: 1-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-3-thiophen-2-yl-urea Openeye Name: 1-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]-3-(2-thienyl)urea CAS Name: 1-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]-3-thiophen-2-ylurea IUPAC Name: 1-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]-3-thiophen-2-ylurea Traditional Name: 1-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-3-(2-thienyl)urea Formula: C20H23N5OS MolecularWeight: 381.49452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)NC3=CC=CS3)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)NC3=CC=CS3)N4CCN(CC4)C

InChI

InChI=1S/C20H23N5OS/c1-14-12-18(25-9-7-24(2)8-10-25)22-17-6-5-15(13-16(14)17)21-20(26)23-19-4-3-11-27-19/h3-6,11-13H,7-10H2,1-2H3,(H2,21,23,26)