1-[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-[(2-methylimidazol-1-yl)methyl]phenyl]urea

Systemtic Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-[(2-methylimidazol-1-yl)methyl]phenyl]urea Openeye Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-[(2-methylimidazol-1-yl)methyl]phenyl]urea CAS Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-[(2-methyl-1-imidazolyl)methyl]phenyl]urea IUPAC Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-[(2-methylimidazol-1-yl)methyl]phenyl]urea Traditional Name: 1-[1-butyl-2-keto-4-(3-methoxyphenyl)-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-[(2-methylimidazol-1-yl)methyl]phenyl]urea Formula: C35H40N6O3 MolecularWeight: 592.7305

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC=N2)C(=C(C1=O)NC(=O)NC3=C(C=CC(=C3)CN4C=CN=C4C)C(C)(C)C)C5=CC(=CC=C5)OC

Isomeric SMILES

CCCCN1C2=C(C=CC=N2)C(=C(C1=O)NC(=O)NC3=C(C=CC(=C3)CN4C=CN=C4C)C(C)(C)C)C5=CC(=CC=C5)OC

InChI

InChI=1S/C35H40N6O3/c1-7-8-18-41-32-27(13-10-16-37-32)30(25-11-9-12-26(21-25)44-6)31(33(41)42)39-34(43)38-29-20-24(14-15-28(29)35(3,4)5)22-40-19-17-36-23(40)2/h9-17,19-21H,7-8,18,22H2,1-6H3,(H2,38,39,43)