1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-cyclohexyl-1-(2-methylpropyl)thiourea

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-cyclohexyl-1-(2-methylpropyl)thiourea Openeye Name: 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-3-cyclohexyl-1-isobutyl-thiourea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-cyclohexyl-1-(2-methylpropyl)thiourea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-cyclohexyl-1-(2-methylpropyl)thiourea Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-3-cyclohexyl-1-isobutyl-thiourea Formula: C22H31N5O2S MolecularWeight: 429.57884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NC3CCCCC3

Isomeric SMILES

CC(C)CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NC3CCCCC3

InChI

InChI=1S/C22H31N5O2S/c1-15(2)13-26(22(30)24-17-11-7-4-8-12-17)18-19(23)27(21(29)25-20(18)28)14-16-9-5-3-6-10-16/h3,5-6,9-10,15,17H,4,7-8,11-14,23H2,1-2H3,(H,24,30)(H,25,28,29)