1-[(3R)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-3-(2-thiophen-2-ylethyl)urea

Systemtic Name: 1-[(3R)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-3-(2-thiophen-2-ylethyl)urea Openeye Name: 1-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-3-[2-(2-thienyl)ethyl]urea CAS Name: 1-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-3-(2-thiophen-2-ylethyl)urea IUPAC Name: 1-[(3R)-4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-3-(2-thiophen-2-ylethyl)urea Traditional Name: 1-[(3R)-4-keto-3,5-dihydro-2H-1,5-benzoxazepin-3-yl]-3-[2-(2-thienyl)ethyl]urea Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=CC=CC=C2O1)NC(=O)NCCC3=CC=CS3

Isomeric SMILES

C1[C@H](C(=O)NC2=CC=CC=C2O1)NC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C16H17N3O3S/c20-15-13(10-22-14-6-2-1-5-12(14)18-15)19-16(21)17-8-7-11-4-3-9-23-11/h1-6,9,13H,7-8,10H2,(H,18,20)(H2,17,19,21)/t13-/m1/s1