(3Z)-3-[4-cyclopropyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-ylidene]indole

Systemtic Name: (3Z)-3-[4-cyclopropyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: (3Z)-3-[4-cyclopropyl-3-(p-tolylmethylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole CAS Name: (3Z)-3-[4-cyclopropyl-3-[(4-methylphenyl)methylthio]-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: (3Z)-3-[4-cyclopropyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: (3Z)-3-[4-cyclopropyl-3-[(4-methylbenzyl)thio]-1H-1,2,4-triazol-5-ylidene]indole Formula: C21H20N4S MolecularWeight: 360.4753

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN/C(=C/3\C=NC4=CC=CC=C43)/N2C5CC5

InChI

InChI=1S/C21H20N4S/c1-14-6-8-15(9-7-14)13-26-21-24-23-20(25(21)16-10-11-16)18-12-22-19-5-3-2-4-17(18)19/h2-9,12,16,23H,10-11,13H2,1H3/b20-18-