4-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CN(C)CC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CN(C)CC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H22N4O2S/c1-21(2)20(27)23-14-8-4-6-10-16(14)25(21)19(26)13-24(3)12-18-22-15-9-5-7-11-17(15)28-18/h4-11H,12-13H2,1-3H3,(H,23,27)