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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(4-bromophenyl)sulfanyl-N-butyl-ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(4-bromophenyl)sulfanyl-N-butyl-acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-[(4-bromophenyl)thio]-N-butylacetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-bromophenyl)sulfanyl-N-butylacetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-[(4-bromophenyl)thio]-N-butyl-acetamide Formula: C20H27BrN4O3S MolecularWeight: 483.42238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27BrN4O3S/c1-3-5-11-24(16(26)13-29-15-9-7-14(21)8-10-15)17-18(22)25(12-6-4-2)20(28)23-19(17)27/h7-10H,3-6,11-13,22H2,1-2H3,(H,23,27,28)