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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-ethyl-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-ethyl-3-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-ethyl-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-ethyl-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-ethyl-3-(4-fluorobenzyl)thiourea Formula: C18H24FN5O2S MolecularWeight: 393.478863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=S)NCC2=CC=C(C=C2)F)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=S)NCC2=CC=C(C=C2)F)N

InChI

InChI=1S/C18H24FN5O2S/c1-3-5-10-24-15(20)14(16(25)22-17(24)26)23(4-2)18(27)21-11-12-6-8-13(19)9-7-12/h6-9H,3-5,10-11,20H2,1-2H3,(H,21,27)(H,22,25,26)