1-[(E)-(2-chloranylcyclohepten-1-yl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(2-chloranylcyclohepten-1-yl)methylideneamino]thiourea Openeye Name: [(E)-(2-chlorocyclohepten-1-yl)methyleneamino]thiourea CAS Name: [(E)-(2-chloro-1-cycloheptenyl)methylideneamino]thiourea IUPAC Name: [(E)-(2-chlorocyclohepten-1-yl)methylideneamino]thiourea Traditional Name: [(E)-(2-chlorocyclohepten-1-yl)methyleneamino]thiourea Formula: C9H14ClN3S MolecularWeight: 231.74556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(CC1)Cl)C=NNC(=S)N

Isomeric SMILES

C1CCC(=C(CC1)Cl)/C=N/NC(=S)N

InChI

InChI=1S/C9H14ClN3S/c10-8-5-3-1-2-4-7(8)6-12-13-9(11)14/h6H,1-5H2,(H3,11,13,14)/b12-6+