2,3-dimethyl-5-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)-1H-indole

Systemtic Name: 2,3-dimethyl-5-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)-1H-indole Openeye Name: 5-(4-allyl-5-isopropylsulfanyl-1,2,4-triazol-3-yl)-2,3-dimethyl-1H-indole CAS Name: 2,3-dimethyl-5-[5-(propan-2-ylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]-1H-indole IUPAC Name: 2,3-dimethyl-5-(5-propan-2-ylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)-1H-indole Traditional Name: 5-[4-allyl-5-(isopropylthio)-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole Formula: C18H22N4S MolecularWeight: 326.45908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3CC=C)SC(C)C)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3CC=C)SC(C)C)C

InChI

InChI=1S/C18H22N4S/c1-6-9-22-17(20-21-18(22)23-11(2)3)14-7-8-16-15(10-14)12(4)13(5)19-16/h6-8,10-11,19H,1,9H2,2-5H3