1-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one

Systemtic Name: 1-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Openeye Name: 1-[1-(p-tolyl)tetrazol-5-yl]sulfanyl-3-(1,3,3-trimethylindolin-2-ylidene)propan-2-one CAS Name: 1-[[1-(4-methylphenyl)-5-tetrazolyl]thio]-3-(1,3,3-trimethyl-2-indolylidene)-2-propanone IUPAC Name: 1-[1-(4-methylphenyl)tetrazol-5-yl]sulfanyl-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Traditional Name: 1-[[1-(p-tolyl)tetrazol-5-yl]thio]-3-(1,3,3-trimethylindolin-2-ylidene)acetone Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)C=C3C(C4=CC=CC=C4N3C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)C=C3C(C4=CC=CC=C4N3C)(C)C

InChI

InChI=1S/C22H23N5OS/c1-15-9-11-16(12-10-15)27-21(23-24-25-27)29-14-17(28)13-20-22(2,3)18-7-5-6-8-19(18)26(20)4/h5-13H,14H2,1-4H3