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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-cyclopentyl-3-(2-fluorophenyl)thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-cyclopentyl-3-(2-fluorophenyl)thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-cyclopentyl-3-(2-fluorophenyl)thiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-cyclopentyl-3-(2-fluorophenyl)thiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-cyclopentyl-3-(2-fluorophenyl)thiourea Formula: C20H26FN5O2S MolecularWeight: 419.516143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=S)NC3=CC=CC=C3F)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=S)NC3=CC=CC=C3F)N

InChI

InChI=1S/C20H26FN5O2S/c1-2-3-12-25-17(22)16(18(27)24-19(25)28)26(13-8-4-5-9-13)20(29)23-15-11-7-6-10-14(15)21/h6-7,10-11,13H,2-5,8-9,12,22H2,1H3,(H,23,29)(H,24,27,28)