1-[5-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]pentyl]-1-heptyl-3-propan-2-yl-urea

Systemtic Name: 1-[5-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]pentyl]-1-heptyl-3-propan-2-yl-urea Openeye Name: 1-[5-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]pentyl]-1-heptyl-3-isopropyl-urea CAS Name: 1-[5-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]pentyl]-1-heptyl-3-propan-2-ylurea IUPAC Name: 1-[5-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]pentyl]-1-heptyl-3-propan-2-ylurea Traditional Name: 1-[5-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]pentyl]-1-heptyl-3-isopropyl-urea Formula: C20H37N5O2S MolecularWeight: 411.60508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCCCSC1=NC(=O)C=C(N1)N)C(=O)NC(C)C

Isomeric SMILES

CCCCCCCN(CCCCCSC1=NC(=O)C=C(N1)N)C(=O)NC(C)C

InChI

InChI=1S/C20H37N5O2S/c1-4-5-6-7-9-12-25(20(27)22-16(2)3)13-10-8-11-14-28-19-23-17(21)15-18(26)24-19/h15-16H,4-14H2,1-3H3,(H,22,27)(H3,21,23,24,26)