1-cyclohexyl-3-(3-methoxypropyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclohexyl-3-(3-methoxypropyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclohexyl-3-(3-methoxypropyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclohexyl-3-(3-methoxypropyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclohexyl-3-(3-methoxypropyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclohexyl-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea Formula: C22H31N3O2S MolecularWeight: 401.56544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NCCCOC

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NCCCOC

InChI

InChI=1S/C22H31N3O2S/c1-16-8-6-9-17-14-18(21(26)24-20(16)17)15-25(19-10-4-3-5-11-19)22(28)23-12-7-13-27-2/h6,8-9,14,19H,3-5,7,10-13,15H2,1-2H3,(H,23,28)(H,24,26)