N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-2-[methyl(thiophen-3-ylmethyl)amino]ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-cyclopentyl-2-[methyl(thiophen-3-ylmethyl)amino]ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-cyclopentyl-2-[methyl(3-thienylmethyl)amino]acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-cyclopentyl-2-[methyl(3-thiophenylmethyl)amino]acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-cyclopentyl-2-[methyl(thiophen-3-ylmethyl)amino]acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-cyclopentyl-2-[methyl(3-thenyl)amino]acetamide Formula: C21H31N5O3S MolecularWeight: 433.56754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)CN(C)CC3=CSC=C3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=O)CN(C)CC3=CSC=C3)N

InChI

InChI=1S/C21H31N5O3S/c1-3-4-10-25-19(22)18(20(28)23-21(25)29)26(16-7-5-6-8-16)17(27)13-24(2)12-15-9-11-30-14-15/h9,11,14,16H,3-8,10,12-13,22H2,1-2H3,(H,23,28,29)