1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(furan-2-ylmethyl)thiourea Openeye Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(2-furylmethyl)thiourea CAS Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(2-furanylmethyl)thiourea IUPAC Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2,4-dimethylphenyl)-1-(furan-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dimethylphenyl)-1-(2-furfuryl)-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C26H27N3O2S MolecularWeight: 445.57648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C(=C(C=C4)C)C)NC3=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=CO2)CC3=CC4=C(C(=C(C=C4)C)C)NC3=O)C

InChI

InChI=1S/C26H27N3O2S/c1-16-7-10-23(18(3)12-16)27-26(32)29(15-22-6-5-11-31-22)14-21-13-20-9-8-17(2)19(4)24(20)28-25(21)30/h5-13H,14-15H2,1-4H3,(H,27,32)(H,28,30)