1-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)-1-(thiophen-2-ylmethyl)urea

Systemtic Name: 1-[(6,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)-1-(thiophen-2-ylmethyl)urea Openeye Name: 3-benzyl-1-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-thienylmethyl)urea CAS Name: 1-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)-1-(thiophen-2-ylmethyl)urea IUPAC Name: 3-benzyl-1-[(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)urea Traditional Name: 3-benzyl-1-[(2-keto-6,8-dimethyl-1H-quinolin-3-yl)methyl]-1-(2-thenyl)urea Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CS3)C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CS3)C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C25H25N3O2S/c1-17-11-18(2)23-20(12-17)13-21(24(29)27-23)15-28(16-22-9-6-10-31-22)25(30)26-14-19-7-4-3-5-8-19/h3-13H,14-16H2,1-2H3,(H,26,30)(H,27,29)