6-chloranyl-4-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[[1-(4-methoxyphenyl)tetrazol-5-yl]thio]methyl]-7-methyl-coumarin Formula: C19H15ClN4O3S MolecularWeight: 414.8654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=NN3C4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NN=NN3C4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C19H15ClN4O3S/c1-11-7-17-15(9-16(11)20)12(8-18(25)27-17)10-28-19-21-22-23-24(19)13-3-5-14(26-2)6-4-13/h3-9H,10H2,1-2H3