3-[3-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1H-1,2,4-triazol-5-ylidene]indole

Systemtic Name: 3-[3-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: 3-[3-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1H-1,2,4-triazol-5-ylidene]indole CAS Name: 3-[3-[(2,5-dimethylphenyl)methylthio]-4-methyl-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: 3-[3-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: 3-[3-[(2,5-dimethylbenzyl)thio]-4-methyl-1H-1,2,4-triazol-5-ylidene]indole Formula: C20H20N4S MolecularWeight: 348.4646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C

InChI

InChI=1S/C20H20N4S/c1-13-8-9-14(2)15(10-13)12-25-20-23-22-19(24(20)3)17-11-21-18-7-5-4-6-16(17)18/h4-11,22H,12H2,1-3H3