1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(2-methylpropyl)-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(2-methylpropyl)-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-isobutyl-3-(4-isopropylphenyl)thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-(2-methylpropyl)-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-(2-methylpropyl)-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-isobutyl-3-p-cumenyl-thiourea Formula: C22H33N5O2S MolecularWeight: 431.59472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=S)NC2=CC=C(C=C2)C(C)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=S)NC2=CC=C(C=C2)C(C)C)N

InChI

InChI=1S/C22H33N5O2S/c1-6-7-12-26-19(23)18(20(28)25-21(26)29)27(13-14(2)3)22(30)24-17-10-8-16(9-11-17)15(4)5/h8-11,14-15H,6-7,12-13,23H2,1-5H3,(H,24,30)(H,25,28,29)