3-[4-cyclopropyl-3-[2-(4-methoxyphenyl)ethylsulfanyl]-1H-1,2,4-triazol-5-ylidene]indole

Systemtic Name: 3-[4-cyclopropyl-3-[2-(4-methoxyphenyl)ethylsulfanyl]-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: 3-[4-cyclopropyl-3-[2-(4-methoxyphenyl)ethylsulfanyl]-1H-1,2,4-triazol-5-ylidene]indole CAS Name: 3-[4-cyclopropyl-3-[2-(4-methoxyphenyl)ethylthio]-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: 3-[4-cyclopropyl-3-[2-(4-methoxyphenyl)ethylsulfanyl]-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: 3-[4-cyclopropyl-3-[2-(4-methoxyphenyl)ethylthio]-1H-1,2,4-triazol-5-ylidene]indole Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5CC5

Isomeric SMILES

COC1=CC=C(C=C1)CCSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5CC5

InChI

InChI=1S/C22H22N4OS/c1-27-17-10-6-15(7-11-17)12-13-28-22-25-24-21(26(22)16-8-9-16)19-14-23-20-5-3-2-4-18(19)20/h2-7,10-11,14,16,24H,8-9,12-13H2,1H3