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

Systemtic Name: 2-methyl-4-[(3S)-3-(phenylmethyl)piperazin-1-yl]thieno[3,2-c][1]benzazepin-10-one Openeye Name: 4-[(3S)-3-benzylpiperazin-1-yl]-2-methyl-thieno[3,2-c][1]benzazepin-10-one CAS Name: 2-methyl-4-[(3S)-3-(phenylmethyl)-1-piperazinyl]-10-thieno[3,2-c][1]benzazepinone IUPAC Name: 4-[(3S)-3-benzylpiperazin-1-yl]-2-methylthieno[3,2-c][1]benzazepin-10-one Traditional Name: 4-[(3S)-3-benzylpiperazino]-2-methyl-thieno[3,2-c][1]benzazepin-10-one Formula: C24H23N3OS MolecularWeight: 401.52392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)C(=O)C3=CC=CC=C3N=C2N4CCNC(C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(S1)C(=O)C3=CC=CC=C3N=C2N4CCN[C@H](C4)CC5=CC=CC=C5

InChI

InChI=1S/C24H23N3OS/c1-16-13-20-23(29-16)22(28)19-9-5-6-10-21(19)26-24(20)27-12-11-25-18(15-27)14-17-7-3-2-4-8-17/h2-10,13,18,25H,11-12,14-15H2,1H3/t18-/m0/s1