1-[4-(azepan-1-ylcarbonyl)phenyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)phenyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[4-(azepane-1-carbonyl)phenyl]thiourea CAS Name: 1-[4-[1-azepanyl(oxo)methyl]phenyl]-3-prop-2-enylthiourea IUPAC Name: 1-[4-(azepane-1-carbonyl)phenyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[4-(azepane-1-carbonyl)phenyl]thiourea Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3OS/c1-2-11-18-17(22)19-15-9-7-14(8-10-15)16(21)20-12-5-3-4-6-13-20/h2,7-10H,1,3-6,11-13H2,(H2,18,19,22)