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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-(3,5-dimethylphenyl)-1-pentyl-thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-(3,5-dimethylphenyl)-1-pentyl-thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-(3,5-dimethylphenyl)-1-pentylthiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-(3,5-dimethylphenyl)-1-pentylthiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-amyl-3-(3,5-dimethylphenyl)thiourea Formula: C22H33N5O2S MolecularWeight: 431.59472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=S)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=S)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C22H33N5O2S/c1-5-7-9-11-26(22(30)24-17-13-15(3)12-16(4)14-17)18-19(23)27(10-8-6-2)21(29)25-20(18)28/h12-14H,5-11,23H2,1-4H3,(H,24,30)(H,25,28,29)