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

Systemtic Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(pyridin-4-ylmethoxymethyl)phenyl]urea Openeye Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(4-pyridylmethoxymethyl)phenyl]urea CAS Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(pyridin-4-ylmethoxymethyl)phenyl]urea IUPAC Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(pyridin-4-ylmethoxymethyl)phenyl]urea Traditional Name: 1-[1-butyl-2-keto-4-(3-methoxyphenyl)-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(4-pyridylmethoxymethyl)phenyl]urea Formula: C37H41N5O4 MolecularWeight: 619.75254

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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)COCC4=CC=NC=C4)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)COCC4=CC=NC=C4)C(C)(C)C)C5=CC(=CC=C5)OC

InChI

InChI=1S/C37H41N5O4/c1-6-7-20-42-34-29(12-9-17-39-34)32(27-10-8-11-28(22-27)45-5)33(35(42)43)41-36(44)40-31-21-26(13-14-30(31)37(2,3)4)24-46-23-25-15-18-38-19-16-25/h8-19,21-22H,6-7,20,23-24H2,1-5H3,(H2,40,41,44)