3-butyl-1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 3-butyl-1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-butyl-1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-butyl-1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-butyl-1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-butyl-1-[3-(dimethylamino)propyl]-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C22H34N4OS MolecularWeight: 402.59656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CCCN(C)C)CC1=CC2=C(C=C(C=C2NC1=O)C)C

Isomeric SMILES

CCCCNC(=S)N(CCCN(C)C)CC1=CC2=C(C=C(C=C2NC1=O)C)C

InChI

InChI=1S/C22H34N4OS/c1-6-7-9-23-22(28)26(11-8-10-25(4)5)15-18-14-19-17(3)12-16(2)13-20(19)24-21(18)27/h12-14H,6-11,15H2,1-5H3,(H,23,28)(H,24,27)