2-tert-butyl-4-(4-methyl-3-phenethyl-piperazin-1-yl)-5H-thieno[3,2-c][1,5]benzodiazepine

Systemtic Name: 2-tert-butyl-4-(4-methyl-3-phenethyl-piperazin-1-yl)-5H-thieno[3,2-c][1,5]benzodiazepine Openeye Name: 2-tert-butyl-4-(4-methyl-3-phenethyl-piperazin-1-yl)-5H-thieno[3,2-c][1,5]benzodiazepine CAS Name: 2-tert-butyl-4-(4-methyl-3-phenethyl-1-piperazinyl)-5H-thieno[3,2-c][1,5]benzodiazepine IUPAC Name: 2-tert-butyl-4-(4-methyl-3-phenethylpiperazin-1-yl)-5H-thieno[3,2-c][1,5]benzodiazepine Traditional Name: 2-tert-butyl-4-(4-methyl-3-phenethyl-piperazino)-5H-thieno[3,2-c][1,5]benzodiazepine Formula: C28H34N4S MolecularWeight: 458.66136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(NC3=CC=CC=C3N=C2S1)N4CCN(C(C4)CCC5=CC=CC=C5)C

Isomeric SMILES

CC(C)(C)C1=CC2=C(NC3=CC=CC=C3N=C2S1)N4CCN(C(C4)CCC5=CC=CC=C5)C

InChI

InChI=1S/C28H34N4S/c1-28(2,3)25-18-22-26(29-23-12-8-9-13-24(23)30-27(22)33-25)32-17-16-31(4)21(19-32)15-14-20-10-6-5-7-11-20/h5-13,18,21,29H,14-17,19H2,1-4H3