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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(methylsulfanylmethyl)-N-(phenylmethyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-benzyl-4-(methylsulfanylmethyl)benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-[(methylthio)methyl]-N-(phenylmethyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-benzyl-4-(methylsulfanylmethyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-benzyl-4-[(methylthio)methyl]benzamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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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)CSC)N

Isomeric SMILES

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

InChI

InChI=1S/C24H28N4O3S/c1-3-4-14-27-21(25)20(22(29)26-24(27)31)28(15-17-8-6-5-7-9-17)23(30)19-12-10-18(11-13-19)16-32-2/h5-13H,3-4,14-16,25H2,1-2H3,(H,26,29,31)