1-[4-(azepan-1-ylcarbonyl)phenyl]-3-ethyl-thiourea

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)phenyl]-3-ethyl-thiourea Openeye Name: 1-[4-(azepane-1-carbonyl)phenyl]-3-ethyl-thiourea CAS Name: 1-[4-[1-azepanyl(oxo)methyl]phenyl]-3-ethylthiourea IUPAC Name: 1-[4-(azepane-1-carbonyl)phenyl]-3-ethylthiourea Traditional Name: 1-[4-(azepane-1-carbonyl)phenyl]-3-ethyl-thiourea Formula: C16H23N3OS MolecularWeight: 305.43832

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=CC=C(C=C1)C(=O)N2CCCCCC2

Isomeric SMILES

CCNC(=S)NC1=CC=C(C=C1)C(=O)N2CCCCCC2

InChI

InChI=1S/C16H23N3OS/c1-2-17-16(21)18-14-9-7-13(8-10-14)15(20)19-11-5-3-4-6-12-19/h7-10H,2-6,11-12H2,1H3,(H2,17,18,21)