(9R)-6-methylidene-9-thiophen-2-yl-8,9,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: (9R)-6-methylidene-9-thiophen-2-yl-8,9,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: (9R)-6-methylene-9-(2-thienyl)-8,9,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one CAS Name: (9R)-6-methylene-9-thiophen-2-yl-8,9,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: (9R)-6-methylidene-9-thiophen-2-yl-8,9,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: (9R)-6-methylene-9-(2-thienyl)-8,9,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=C(CC(CC2=O)C3=CC=CS3)NC4=CC=CC=C4N1

Isomeric SMILES

C=C1C2=C(C[C@H](CC2=O)C3=CC=CS3)NC4=CC=CC=C4N1

InChI

InChI=1S/C18H16N2OS/c1-11-18-15(20-14-6-3-2-5-13(14)19-11)9-12(10-16(18)21)17-7-4-8-22-17/h2-8,12,19-20H,1,9-10H2/t12-/m1/s1