1-[5-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-1-(4-methoxyphenyl)-2-methyl-indol-3-yl]ethanone

Systemtic Name: 1-[5-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-1-(4-methoxyphenyl)-2-methyl-indol-3-yl]ethanone Openeye Name: 1-[5-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]-1-(4-methoxyphenyl)-2-methyl-indol-3-yl]ethanone CAS Name: 1-[5-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-1-(4-methoxyphenyl)-2-methyl-3-indolyl]ethanone IUPAC Name: 1-[5-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-1-(4-methoxyphenyl)-2-methylindol-3-yl]ethanone Traditional Name: 1-[5-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]-1-(4-methoxyphenyl)-2-methyl-indol-3-yl]ethanone Formula: C21H21N5O3S MolecularWeight: 423.48814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OCC4=NNC(=S)N4N)C(=O)C

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OCC4=NNC(=S)N4N)C(=O)C

InChI

InChI=1S/C21H21N5O3S/c1-12-20(13(2)27)17-10-16(29-11-19-23-24-21(30)26(19)22)8-9-18(17)25(12)14-4-6-15(28-3)7-5-14/h4-10H,11,22H2,1-3H3,(H,24,30)