7,8-dimethyl-4-[(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)methyl]chromen-2-one

Systemtic Name: 7,8-dimethyl-4-[(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)methyl]chromen-2-one Openeye Name: 7,8-dimethyl-4-[[5-(3-thienyl)tetrazol-2-yl]methyl]chromen-2-one CAS Name: 7,8-dimethyl-4-[[5-(3-thiophenyl)-2-tetrazolyl]methyl]-1-benzopyran-2-one IUPAC Name: 7,8-dimethyl-4-[(5-thiophen-3-yltetrazol-2-yl)methyl]chromen-2-one Traditional Name: 7,8-dimethyl-4-[[5-(3-thienyl)tetrazol-2-yl]methyl]coumarin Formula: C17H14N4O2S MolecularWeight: 338.38366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3N=C(N=N3)C4=CSC=C4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3N=C(N=N3)C4=CSC=C4)C

InChI

InChI=1S/C17H14N4O2S/c1-10-3-4-14-13(7-15(22)23-16(14)11(10)2)8-21-19-17(18-20-21)12-5-6-24-9-12/h3-7,9H,8H2,1-2H3