1-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one

Systemtic Name: 1-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Openeye Name: 1-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(1,3,3-trimethylindolin-2-ylidene)propan-2-one CAS Name: 1-[[4-methyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-3-(1,3,3-trimethyl-2-indolylidene)-2-propanone IUPAC Name: 1-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Traditional Name: 1-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-3-(1,3,3-trimethylindolin-2-ylidene)acetone Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)CSC3=NN=C(N3C)C4=CN=CC=C4)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC(=O)CSC3=NN=C(N3C)C4=CN=CC=C4)C)C

InChI

InChI=1S/C22H23N5OS/c1-22(2)17-9-5-6-10-18(17)26(3)19(22)12-16(28)14-29-21-25-24-20(27(21)4)15-8-7-11-23-13-15/h5-13H,14H2,1-4H3