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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-4-(dimethylsulfamoyl)-N-(2-methylpropyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-4-(dimethylsulfamoyl)-N-isobutyl-benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-4-(dimethylsulfamoyl)-N-(2-methylpropyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-4-(dimethylsulfamoyl)-N-(2-methylpropyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-4-(dimethylsulfamoyl)-N-isobutyl-benzamide Formula: C21H31N5O5S MolecularWeight: 465.56634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N5O5S/c1-6-7-12-25-18(22)17(19(27)23-21(25)29)26(13-14(2)3)20(28)15-8-10-16(11-9-15)32(30,31)24(4)5/h8-11,14H,6-7,12-13,22H2,1-5H3,(H,23,27,29)