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

Systemtic Name: 1-[3-(2-oxidanylideneazepan-1-yl)propyl]-3-phenethyl-thiourea Openeye Name: 1-[3-(2-oxoazepan-1-yl)propyl]-3-phenethyl-thiourea CAS Name: 1-[3-(2-oxo-1-azepanyl)propyl]-3-phenethylthiourea IUPAC Name: 1-[3-(2-oxoazepan-1-yl)propyl]-3-phenethylthiourea Traditional Name: 1-[3-(2-ketoazepan-1-yl)propyl]-3-phenethyl-thiourea Formula: C18H27N3OS MolecularWeight: 333.49148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C18H27N3OS/c22-17-10-5-2-6-14-21(17)15-7-12-19-18(23)20-13-11-16-8-3-1-4-9-16/h1,3-4,8-9H,2,5-7,10-15H2,(H2,19,20,23)