O-[4-(quinoxalin-6-ylcarbamoyl)phenyl] 2-methyl-2,3-dihydroindole-1-carbothioate

Systemtic Name: O-[4-(quinoxalin-6-ylcarbamoyl)phenyl] 2-methyl-2,3-dihydroindole-1-carbothioate Openeye Name: O-[4-(quinoxalin-6-ylcarbamoyl)phenyl] 2-methylindoline-1-carbothioate CAS Name: 2-methyl-2,3-dihydroindole-1-carbothioic acid O-[4-[oxo-(6-quinoxalinylamino)methyl]phenyl] ester IUPAC Name: O-[4-(quinoxalin-6-ylcarbamoyl)phenyl] 2-methyl-2,3-dihydroindole-1-carbothioate Traditional Name: 2-methylindoline-1-carbothioic acid O-[4-(quinoxalin-6-ylcarbamoyl)phenyl] ester Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=S)OC3=CC=C(C=C3)C(=O)NC4=CC5=NC=CN=C5C=C4

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=S)OC3=CC=C(C=C3)C(=O)NC4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C25H20N4O2S/c1-16-14-18-4-2-3-5-23(18)29(16)25(32)31-20-9-6-17(7-10-20)24(30)28-19-8-11-21-22(15-19)27-13-12-26-21/h2-13,15-16H,14H2,1H3,(H,28,30)