2-methyl-4-piperazin-4-ium-1-yl-5H-thieno[3,2-c][1,5]benzodiazepine

Systemtic Name: 2-methyl-4-piperazin-4-ium-1-yl-5H-thieno[3,2-c][1,5]benzodiazepine Openeye Name: 2-methyl-4-piperazin-4-ium-1-yl-5H-thieno[3,2-c][1,5]benzodiazepine CAS Name: 2-methyl-4-(1-piperazin-4-iumyl)-5H-thieno[3,2-c][1,5]benzodiazepine IUPAC Name: 2-methyl-4-piperazin-4-ium-1-yl-5H-thieno[3,2-c][1,5]benzodiazepine Traditional Name: 2-methyl-4-piperazin-4-ium-1-yl-5H-thieno[3,2-c][1,5]benzodiazepine Formula: C16H19N4S+ MolecularWeight: 299.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(NC3=CC=CC=C3N=C2S1)N4CC[NH2+]CC4

Isomeric SMILES

CC1=CC2=C(NC3=CC=CC=C3N=C2S1)N4CC[NH2+]CC4

InChI

InChI=1S/C16H18N4S/c1-11-10-12-15(20-8-6-17-7-9-20)18-13-4-2-3-5-14(13)19-16(12)21-11/h2-5,10,17-18H,6-9H2,1H3/p+1