5-cyclopropylcarbonyl-9,9-dimethyl-6-thiophen-2-yl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 5-cyclopropylcarbonyl-9,9-dimethyl-6-thiophen-2-yl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Openeye Name: 5-(cyclopropanecarbonyl)-9,9-dimethyl-6-(2-thienyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one CAS Name: 5-[cyclopropyl(oxo)methyl]-9,9-dimethyl-6-thiophen-2-yl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-(cyclopropanecarbonyl)-9,9-dimethyl-6-thiophen-2-yl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Traditional Name: 5-(cyclopropanecarbonyl)-9,9-dimethyl-6-(2-thienyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4CC4)C5=CC=CS5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4CC4)C5=CC=CS5)C(=O)C1)C

InChI

InChI=1S/C23H24N2O2S/c1-23(2)12-16-20(18(26)13-23)21(19-8-5-11-28-19)25(22(27)14-9-10-14)17-7-4-3-6-15(17)24-16/h3-8,11,14,21,24H,9-10,12-13H2,1-2H3