N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-methyl-N-(phenylmethyl)-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-methyl-N-(phenylmethyl)-3-pyrrol-1-yl-benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-benzyl-4-methyl-3-pyrrol-1-yl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-methyl-N-(phenylmethyl)-3-(1-pyrrolyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-benzyl-4-methyl-3-pyrrol-1-ylbenzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-benzyl-4-methyl-3-pyrrol-1-yl-benzamide Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)C)N4C=CC=C4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)C)N4C=CC=C4)N

InChI

InChI=1S/C27H29N5O3/c1-3-4-16-31-24(28)23(25(33)29-27(31)35)32(18-20-10-6-5-7-11-20)26(34)21-13-12-19(2)22(17-21)30-14-8-9-15-30/h5-15,17H,3-4,16,18,28H2,1-2H3,(H,29,33,35)