(6-thiophen-2-ylpyrrolo[2,1-d][1,5]benzoxazepin-7-yl) N,N-diethylcarbamate

Systemtic Name: (6-thiophen-2-ylpyrrolo[2,1-d][1,5]benzoxazepin-7-yl) N,N-diethylcarbamate Openeye Name: [6-(2-thienyl)pyrrolo[2,1-d][1,5]benzoxazepin-7-yl] N,N-diethylcarbamate CAS Name: N,N-diethylcarbamic acid (6-thiophen-2-yl-7-pyrrolo[2,1-d][1,5]benzoxazepinyl) ester IUPAC Name: (6-thiophen-2-ylpyrrolo[2,1-d][1,5]benzoxazepin-7-yl) N,N-diethylcarbamate Traditional Name: N,N-diethylcarbamic acid [6-(2-thienyl)pyrrolo[2,1-d][1,5]benzoxazepin-7-yl] ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)OC1=C(OC2=CC=CC=C2N3C1=CC=C3)C4=CC=CS4

Isomeric SMILES

CCN(CC)C(=O)OC1=C(OC2=CC=CC=C2N3C1=CC=C3)C4=CC=CS4

InChI

InChI=1S/C21H20N2O3S/c1-3-22(4-2)21(24)26-19-16-10-7-13-23(16)15-9-5-6-11-17(15)25-20(19)18-12-8-14-27-18/h5-14H,3-4H2,1-2H3