2-methyl-4-(4-methylpiperazin-1-yl)-10-prop-2-ynyl-thieno[2,3-b][1,5]benzodiazepine

Systemtic Name: 2-methyl-4-(4-methylpiperazin-1-yl)-10-prop-2-ynyl-thieno[2,3-b][1,5]benzodiazepine Openeye Name: 2-methyl-4-(4-methylpiperazin-1-yl)-10-prop-2-ynyl-thieno[2,3-b][1,5]benzodiazepine CAS Name: 2-methyl-4-(4-methyl-1-piperazinyl)-10-prop-2-ynylthieno[2,3-b][1,5]benzodiazepine IUPAC Name: 2-methyl-4-(4-methylpiperazin-1-yl)-10-prop-2-ynylthieno[2,3-b][1,5]benzodiazepine Traditional Name: 2-methyl-4-(4-methylpiperazino)-10-propargyl-thieno[2,3-b][1,5]benzodiazepine Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N(C3=CC=CC=C3N=C2N4CCN(CC4)C)CC#C

Isomeric SMILES

CC1=CC2=C(S1)N(C3=CC=CC=C3N=C2N4CCN(CC4)C)CC#C

InChI

InChI=1S/C20H22N4S/c1-4-9-24-18-8-6-5-7-17(18)21-19(16-14-15(2)25-20(16)24)23-12-10-22(3)11-13-23/h1,5-8,14H,9-13H2,2-3H3