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

Systemtic Name: 1-(3-methoxyphenyl)-3-[3-(2-oxidanylideneazepan-1-yl)propyl]thiourea Openeye Name: 1-(3-methoxyphenyl)-3-[3-(2-oxoazepan-1-yl)propyl]thiourea CAS Name: 1-(3-methoxyphenyl)-3-[3-(2-oxo-1-azepanyl)propyl]thiourea IUPAC Name: 1-(3-methoxyphenyl)-3-[3-(2-oxoazepan-1-yl)propyl]thiourea Traditional Name: 1-[3-(2-ketoazepan-1-yl)propyl]-3-(3-methoxyphenyl)thiourea Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NCCCN2CCCCCC2=O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NCCCN2CCCCCC2=O

InChI

InChI=1S/C17H25N3O2S/c1-22-15-8-5-7-14(13-15)19-17(23)18-10-6-12-20-11-4-2-3-9-16(20)21/h5,7-8,13H,2-4,6,9-12H2,1H3,(H2,18,19,23)