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

Systemtic Name: 2-methyl-4-[(3S)-4-methyl-3-phenethyl-piperazin-1-yl]-10H-thieno[3,2-c][1]benzazepine Openeye Name: 2-methyl-4-[(3S)-4-methyl-3-phenethyl-piperazin-1-yl]-10H-thieno[3,2-c][1]benzazepine CAS Name: 2-methyl-4-[(3S)-4-methyl-3-phenethyl-1-piperazinyl]-10H-thieno[3,2-c][1]benzazepine IUPAC Name: 2-methyl-4-[(3S)-4-methyl-3-phenethylpiperazin-1-yl]-10H-thieno[3,2-c][1]benzazepine Traditional Name: 2-methyl-4-[(3S)-4-methyl-3-phenethyl-piperazino]-10H-thieno[3,2-c][1]benzazepine Formula: C26H29N3S MolecularWeight: 415.59356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)CC3=CC=CC=C3N=C2N4CCN(C(C4)CCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC2=C(S1)CC3=CC=CC=C3N=C2N4CCN([C@H](C4)CCC5=CC=CC=C5)C

InChI

InChI=1S/C26H29N3S/c1-19-16-23-25(30-19)17-21-10-6-7-11-24(21)27-26(23)29-15-14-28(2)22(18-29)13-12-20-8-4-3-5-9-20/h3-11,16,22H,12-15,17-18H2,1-2H3/t22-/m0/s1