pyridin-3-yl-(4-thiophen-2-yl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-5-yl)methanone

Systemtic Name: pyridin-3-yl-(4-thiophen-2-yl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-5-yl)methanone Openeye Name: 3-pyridyl-[4-(2-thienyl)-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-5-yl]methanone CAS Name: 3-pyridinyl-(4-thiophen-2-yl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-5-yl)methanone IUPAC Name: pyridin-3-yl-(4-thiophen-2-yl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-5-yl)methanone Traditional Name: 3-pyridyl-[4-(2-thienyl)-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepin-5-yl]methanone Formula: C22H17N3OS MolecularWeight: 371.45488

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N3C=CC=C3C(N1C(=O)C4=CN=CC=C4)C5=CC=CS5

Isomeric SMILES

C1C2=CC=CC=C2N3C=CC=C3C(N1C(=O)C4=CN=CC=C4)C5=CC=CS5

InChI

InChI=1S/C22H17N3OS/c26-22(16-7-3-11-23-14-16)25-15-17-6-1-2-8-18(17)24-12-4-9-19(24)21(25)20-10-5-13-27-20/h1-14,21H,15H2