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

Systemtic Name: 7-fluoranyl-2-methyl-4-(4-methylpiperazin-1-yl)-10-prop-2-ynyl-thieno[2,3-b][1,5]benzodiazepine Openeye Name: 7-fluoro-2-methyl-4-(4-methylpiperazin-1-yl)-10-prop-2-ynyl-thieno[2,3-b][1,5]benzodiazepine CAS Name: 7-fluoro-2-methyl-4-(4-methyl-1-piperazinyl)-10-prop-2-ynylthieno[2,3-b][1,5]benzodiazepine IUPAC Name: 7-fluoro-2-methyl-4-(4-methylpiperazin-1-yl)-10-prop-2-ynylthieno[2,3-b][1,5]benzodiazepine Traditional Name: 7-fluoro-2-methyl-4-(4-methylpiperazino)-10-propargyl-thieno[2,3-b][1,5]benzodiazepine Formula: C20H21FN4S MolecularWeight: 368.470943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21FN4S/c1-4-7-25-18-6-5-15(21)13-17(18)22-19(16-12-14(2)26-20(16)25)24-10-8-23(3)9-11-24/h1,5-6,12-13H,7-11H2,2-3H3