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

Systemtic Name: (3Z)-3-[4-cyclopropyl-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole Openeye Name: (3Z)-3-[4-cyclopropyl-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole CAS Name: (3Z)-3-[4-cyclopropyl-3-(3-methylbut-2-enylthio)-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: (3Z)-3-[4-cyclopropyl-3-(3-methylbut-2-enylsulfanyl)-1H-1,2,4-triazol-5-ylidene]indole Traditional Name: (3Z)-3-[4-cyclopropyl-3-(3-methylbut-2-enylthio)-1H-1,2,4-triazol-5-ylidene]indole Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NNC(=C2C=NC3=CC=CC=C32)N1C4CC4)C

Isomeric SMILES

CC(=CCSC1=NN/C(=C/2\C=NC3=CC=CC=C32)/N1C4CC4)C

InChI

InChI=1S/C18H20N4S/c1-12(2)9-10-23-18-21-20-17(22(18)13-7-8-13)15-11-19-16-6-4-3-5-14(15)16/h3-6,9,11,13,20H,7-8,10H2,1-2H3/b17-15-