N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-5-bromanyl-N-(3-methoxypropyl)thiophene-2-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-5-bromanyl-N-(3-methoxypropyl)thiophene-2-carboxamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-5-bromo-N-(3-methoxypropyl)thiophene-2-carboxamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-5-bromo-N-(3-methoxypropyl)-2-thiophenecarboxamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-5-bromo-N-(3-methoxypropyl)thiophene-2-carboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-5-bromo-N-(3-methoxypropyl)thiophene-2-carboxamide Formula: C20H21BrN4O4S MolecularWeight: 493.37414

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC=C(S3)Br

Isomeric SMILES

COCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C20H21BrN4O4S/c1-29-11-5-10-24(19(27)14-8-9-15(21)30-14)16-17(22)25(20(28)23-18(16)26)12-13-6-3-2-4-7-13/h2-4,6-9H,5,10-12,22H2,1H3,(H,23,26,28)