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

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(4-bromophenyl)sulfanyl-N-methyl-ethanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-2-(4-bromophenyl)sulfanyl-N-methyl-acetamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-2-[(4-bromophenyl)thio]-N-methylacetamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-2-(4-bromophenyl)sulfanyl-N-methylacetamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-2-[(4-bromophenyl)thio]-N-methyl-acetamide Formula: C20H19BrN4O3S MolecularWeight: 475.35886

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CSC3=CC=C(C=C3)Br

Isomeric SMILES

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H19BrN4O3S/c1-24(16(26)12-29-15-9-7-14(21)8-10-15)17-18(22)25(20(28)23-19(17)27)11-13-5-3-2-4-6-13/h2-10H,11-12,22H2,1H3,(H,23,27,28)