1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-butyl-1-cyclopentyl-urea

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-butyl-1-cyclopentyl-urea Openeye Name: 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-3-butyl-1-cyclopentyl-urea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-butyl-1-cyclopentylurea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-butyl-1-cyclopentylurea Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-3-butyl-1-cyclopentyl-urea Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(C1CCCC1)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N

Isomeric SMILES

CCCCNC(=O)N(C1CCCC1)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N

InChI

InChI=1S/C21H29N5O3/c1-2-3-13-23-20(28)26(16-11-7-8-12-16)17-18(22)25(21(29)24-19(17)27)14-15-9-5-4-6-10-15/h4-6,9-10,16H,2-3,7-8,11-14,22H2,1H3,(H,23,28)(H,24,27,29)