N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(4-ethoxyphenyl)sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(4-ethoxyphenyl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-benzyl-2-(4-ethoxyphenyl)sulfanyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-[(4-ethoxyphenyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-benzyl-2-(4-ethoxyphenyl)sulfanylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-benzyl-2-(p-phenetylthio)acetamide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)CSC3=CC=C(C=C3)OCC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)CSC3=CC=C(C=C3)OCC)N

InChI

InChI=1S/C25H30N4O4S/c1-3-5-15-28-23(26)22(24(31)27-25(28)32)29(16-18-9-7-6-8-10-18)21(30)17-34-20-13-11-19(12-14-20)33-4-2/h6-14H,3-5,15-17,26H2,1-2H3,(H,27,31,32)