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

Systemtic Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(pyrrolidin-1-ylmethyl)phenyl]urea Openeye Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(pyrrolidin-1-ylmethyl)phenyl]urea CAS Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(1-pyrrolidinylmethyl)phenyl]urea IUPAC Name: 1-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(pyrrolidin-1-ylmethyl)phenyl]urea Traditional Name: 1-[1-butyl-2-keto-4-(3-methoxyphenyl)-1,8-naphthyridin-3-yl]-3-[2-tert-butyl-5-(pyrrolidinomethyl)phenyl]urea Formula: C35H43N5O3 MolecularWeight: 581.74762

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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)CN4CCCC4)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)CN4CCCC4)C(C)(C)C)C5=CC(=CC=C5)OC

InChI

InChI=1S/C35H43N5O3/c1-6-7-20-40-32-27(14-11-17-36-32)30(25-12-10-13-26(22-25)43-5)31(33(40)41)38-34(42)37-29-21-24(23-39-18-8-9-19-39)15-16-28(29)35(2,3)4/h10-17,21-22H,6-9,18-20,23H2,1-5H3,(H2,37,38,42)