2-methyl-4-[(3S)-4-methyl-3-(phenylmethyl)piperazin-1-yl]-10H-thieno[3,2-c][1]benzazepine

Systemtic Name: 2-methyl-4-[(3S)-4-methyl-3-(phenylmethyl)piperazin-1-yl]-10H-thieno[3,2-c][1]benzazepine Openeye Name: 4-[(3S)-3-benzyl-4-methyl-piperazin-1-yl]-2-methyl-10H-thieno[3,2-c][1]benzazepine CAS Name: 2-methyl-4-[(3S)-4-methyl-3-(phenylmethyl)-1-piperazinyl]-10H-thieno[3,2-c][1]benzazepine IUPAC Name: 4-[(3S)-3-benzyl-4-methylpiperazin-1-yl]-2-methyl-10H-thieno[3,2-c][1]benzazepine Traditional Name: 4-[(3S)-3-benzyl-4-methyl-piperazino]-2-methyl-10H-thieno[3,2-c][1]benzazepine Formula: C25H27N3S MolecularWeight: 401.56698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)CC3=CC=CC=C3N=C2N4CCN(C(C4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC2=C(S1)CC3=CC=CC=C3N=C2N4CCN([C@H](C4)CC5=CC=CC=C5)C

InChI

InChI=1S/C25H27N3S/c1-18-14-22-24(29-18)16-20-10-6-7-11-23(20)26-25(22)28-13-12-27(2)21(17-28)15-19-8-4-3-5-9-19/h3-11,14,21H,12-13,15-17H2,1-2H3/t21-/m0/s1