2-ethyl-7-fluoranyl-10-(4-prop-2-enylpiperazin-1-yl)-4,5-dihydrothieno[3,2-c][1,5]benzodiazepine

Systemtic Name: 2-ethyl-7-fluoranyl-10-(4-prop-2-enylpiperazin-1-yl)-4,5-dihydrothieno[3,2-c][1,5]benzodiazepine Openeye Name: 10-(4-allylpiperazin-1-yl)-2-ethyl-7-fluoro-4,5-dihydrothieno[3,2-c][1,5]benzodiazepine CAS Name: 2-ethyl-7-fluoro-10-(4-prop-2-enyl-1-piperazinyl)-4,5-dihydrothieno[3,2-c][1,5]benzodiazepine IUPAC Name: 2-ethyl-7-fluoro-10-(4-prop-2-enylpiperazin-1-yl)-4,5-dihydrothieno[3,2-c][1,5]benzodiazepine Traditional Name: 10-(4-allylpiperazino)-2-ethyl-7-fluoro-4,5-dihydrothieno[3,2-c][1,5]benzodiazepine Formula: C20H25FN4S MolecularWeight: 372.502703

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N(C3=C(C=C(C=C3)F)NC2)N4CCN(CC4)CC=C

Isomeric SMILES

CCC1=CC2=C(S1)N(C3=C(C=C(C=C3)F)NC2)N4CCN(CC4)CC=C

InChI

InChI=1S/C20H25FN4S/c1-3-7-23-8-10-24(11-9-23)25-19-6-5-16(21)13-18(19)22-14-15-12-17(4-2)26-20(15)25/h3,5-6,12-13,22H,1,4,7-11,14H2,2H3