N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-5-bromanyl-N-(2-methylpropyl)thiophene-2-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-5-bromanyl-N-(2-methylpropyl)thiophene-2-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-5-bromo-N-isobutyl-thiophene-2-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-5-bromo-N-(2-methylpropyl)-2-thiophenecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-5-bromo-N-(2-methylpropyl)thiophene-2-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-5-bromo-N-isobutyl-thiophene-2-carboxamide Formula: C17H23BrN4O3S MolecularWeight: 443.35852

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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(S2)Br)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC=C(S2)Br)N

InChI

InChI=1S/C17H23BrN4O3S/c1-4-5-8-21-14(19)13(15(23)20-17(21)25)22(9-10(2)3)16(24)11-6-7-12(18)26-11/h6-7,10H,4-5,8-9,19H2,1-3H3,(H,20,23,25)