1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furylmethyl)-3-(4-methoxyphenyl)thiourea CAS Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furanylmethyl)-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(4-methoxyphenyl)thiourea Traditional Name: 1-(2-furfuryl)-1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC3=CC=CO3)C(=S)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC3=CC=CO3)C(=S)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H25N3O3S/c1-16-6-7-17(2)23-22(16)13-18(24(29)27-23)14-28(15-21-5-4-12-31-21)25(32)26-19-8-10-20(30-3)11-9-19/h4-13H,14-15H2,1-3H3,(H,26,32)(H,27,29)