1-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]-3-propyl-thiourea

Systemtic Name: 1-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]-3-propyl-thiourea Openeye Name: 1-[[2-(2-oxoazepan-1-yl)acetyl]amino]-3-propyl-thiourea CAS Name: 1-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]amino]-3-propylthiourea IUPAC Name: 1-[[2-(2-oxoazepan-1-yl)acetyl]amino]-3-propylthiourea Traditional Name: 1-[[2-(2-ketoazepan-1-yl)acetyl]amino]-3-propyl-thiourea Formula: C12H22N4O2S MolecularWeight: 286.39368

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NNC(=O)CN1CCCCCC1=O

Isomeric SMILES

CCCNC(=S)NNC(=O)CN1CCCCCC1=O

InChI

InChI=1S/C12H22N4O2S/c1-2-7-13-12(19)15-14-10(17)9-16-8-5-3-4-6-11(16)18/h2-9H2,1H3,(H,14,17)(H2,13,15,19)