N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4,7,9-trimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]acetamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C3=NN=C(N23)SCC(=O)NC4=CC5=C(C=C4)OCCO5)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C3=NN=C(N23)SCC(=O)NC4=CC5=C(C=C4)OCCO5)C)C

InChI

InChI=1S/C23H22N4O3S/c1-13-8-14(2)21-16(9-13)10-15(3)22-25-26-23(27(21)22)31-12-20(28)24-17-4-5-18-19(11-17)30-7-6-29-18/h4-5,8-11H,6-7,12H2,1-3H3,(H,24,28)