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

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methylpropyl)-1-benzothiophene-2-carboxamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-benzothiophene-2-carboxamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-(2-methylpropyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-(2-methylpropyl)-1-benzothiophene-2-carboxamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-benzothiophene-2-carboxamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC3=CC=CC=C3S2)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC3=CC=CC=C3S2)N

InChI

InChI=1S/C21H26N4O3S/c1-12(2)10-24(20(27)16-9-14-7-5-6-8-15(14)29-16)17-18(22)25(11-13(3)4)21(28)23-19(17)26/h5-9,12-13H,10-11,22H2,1-4H3,(H,23,26,28)