2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-ethyl-2-phenyl-indol-3-yl)ethanone

Systemtic Name: 2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-ethyl-2-phenyl-indol-3-yl)ethanone Openeye Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-ethyl-2-phenyl-indol-3-yl)ethanone CAS Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-(1-ethyl-2-phenyl-3-indolyl)ethanone IUPAC Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-ethyl-2-phenylindol-3-yl)ethanone Traditional Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-(1-ethyl-2-phenyl-indol-3-yl)ethanone Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)CSC4=NN=C(N4N)C

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)CSC4=NN=C(N4N)C

InChI

InChI=1S/C21H21N5OS/c1-3-25-17-12-8-7-11-16(17)19(20(25)15-9-5-4-6-10-15)18(27)13-28-21-24-23-14(2)26(21)22/h4-12H,3,13,22H2,1-2H3