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

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-cyclopentyl-thiophene-2-carboxamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-cyclopentyl-thiophene-2-carboxamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-cyclopentyl-2-thiophenecarboxamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-cyclopentylthiophene-2-carboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-cyclopentyl-thiophene-2-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(C1)N(C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H22N4O3S/c22-18-17(19(26)23-21(28)24(18)13-14-7-2-1-3-8-14)25(15-9-4-5-10-15)20(27)16-11-6-12-29-16/h1-3,6-8,11-12,15H,4-5,9-10,13,22H2,(H,23,26,28)