[(3S)-3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]-quinoxalin-6-yl-methanone

Systemtic Name: [(3S)-3-[(3,4-dimethylphenyl)amino]piperidin-1-yl]-quinoxalin-6-yl-methanone Openeye Name: [(3S)-3-(3,4-dimethylanilino)-1-piperidyl]-quinoxalin-6-yl-methanone CAS Name: [(3S)-3-(3,4-dimethylanilino)-1-piperidinyl]-(6-quinoxalinyl)methanone IUPAC Name: [(3S)-3-(3,4-dimethylanilino)piperidin-1-yl]-quinoxalin-6-ylmethanone Traditional Name: [(3S)-3-(3,4-dimethylanilino)piperidino]-quinoxalin-6-yl-methanone Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2CCCN(C2)C(=O)C3=CC4=NC=CN=C4C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H]2CCCN(C2)C(=O)C3=CC4=NC=CN=C4C=C3)C

InChI

InChI=1S/C22H24N4O/c1-15-5-7-18(12-16(15)2)25-19-4-3-11-26(14-19)22(27)17-6-8-20-21(13-17)24-10-9-23-20/h5-10,12-13,19,25H,3-4,11,14H2,1-2H3/t19-/m0/s1