5-chloranylbicyclo[4.1.0]hepta-1(6),2,4-trien-7-one; 1-[1-(5-ethylthiophen-2-yl)imidazol-2-yl]-N,N-dimethyl-methanamine

Systemtic Name: 5-chloranylbicyclo[4.1.0]hepta-1(6),2,4-trien-7-one; 1-[1-(5-ethylthiophen-2-yl)imidazol-2-yl]-N,N-dimethyl-methanamine Openeye Name: 5-chlorobicyclo[4.1.0]hepta-1(6),2,4-trien-7-one; 1-[1-(5-ethyl-2-thienyl)imidazol-2-yl]-N,N-dimethyl-methanamine CAS Name: 5-chloro-7-bicyclo[4.1.0]hepta-1(6),2,4-trienone; 1-[1-(5-ethyl-2-thiophenyl)-2-imidazolyl]-N,N-dimethylmethanamine IUPAC Name: 5-chlorobicyclo[4.1.0]hepta-1(6),2,4-trien-7-one; 1-[1-(5-ethylthiophen-2-yl)imidazol-2-yl]-N,N-dimethylmethanamine Traditional Name: 5-chlorobicyclo[4.1.0]hepta-1(6),2,4-trien-7-one; [1-(5-ethyl-2-thienyl)imidazol-2-yl]methyl-dimethyl-amine Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)N2C=CN=C2CN(C)C.C1=CC2=C(C2=O)C(=C1)Cl

Isomeric SMILES

CCC1=CC=C(S1)N2C=CN=C2CN(C)C.C1=CC2=C(C2=O)C(=C1)Cl

InChI

InChI=1S/C12H17N3S.C7H3ClO/c1-4-10-5-6-12(16-10)15-8-7-13-11(15)9-14(2)3;8-5-3-1-2-4-6(5)7(4)9/h5-8H,4,9H2,1-3H3;1-3H