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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(4-methylphenyl)sulfanyl-N-(2-methylpropyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-2-(p-tolylsulfanyl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-[(4-methylphenyl)thio]-N-(2-methylpropyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-methylphenyl)sulfanyl-N-(2-methylpropyl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-2-(p-tolylthio)acetamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)CSC2=CC=C(C=C2)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)CSC2=CC=C(C=C2)C)N

InChI

InChI=1S/C21H30N4O3S/c1-5-6-11-24-19(22)18(20(27)23-21(24)28)25(12-14(2)3)17(26)13-29-16-9-7-15(4)8-10-16/h7-10,14H,5-6,11-13,22H2,1-4H3,(H,23,27,28)