4-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]-7-methoxy-chromen-2-one CAS Name: 4-[[[1-(4-chlorophenyl)-5-tetrazolyl]thio]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylmethyl]-7-methoxychromen-2-one Traditional Name: 4-[[[1-(4-chlorophenyl)tetrazol-5-yl]thio]methyl]-7-methoxy-coumarin Formula: C18H13ClN4O3S MolecularWeight: 400.83882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=NN3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H13ClN4O3S/c1-25-14-6-7-15-11(8-17(24)26-16(15)9-14)10-27-18-20-21-22-23(18)13-4-2-12(19)3-5-13/h2-9H,10H2,1H3