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

Systemtic Name: 1-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-cyclohexyl-1-pentyl-thiourea Openeye Name: 1-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-cyclohexyl-1-pentyl-thiourea CAS Name: 1-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-cyclohexyl-1-pentylthiourea IUPAC Name: 1-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-cyclohexyl-1-pentylthiourea Traditional Name: 1-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-amyl-3-cyclohexyl-thiourea Formula: C20H35N5O2S MolecularWeight: 409.5892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=S)NC2CCCCC2

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=S)NC2CCCCC2

InChI

InChI=1S/C20H35N5O2S/c1-3-5-10-14-24(20(28)22-15-11-8-7-9-12-15)16-17(21)25(13-6-4-2)19(27)23-18(16)26/h15H,3-14,21H2,1-2H3,(H,22,28)(H,23,26,27)