1-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-3-(thiophen-2-ylmethyl)urea

Systemtic Name: 1-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-3-(thiophen-2-ylmethyl)urea Openeye Name: 1-(5-methyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-3-(2-thienylmethyl)urea CAS Name: 1-(5-methyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-3-(thiophen-2-ylmethyl)urea IUPAC Name: 1-(5-methyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-3-(thiophen-2-ylmethyl)urea Traditional Name: 1-(6-keto-5-methyl-benzo[b][1,4]benzoxazepin-8-yl)-3-(2-thenyl)urea Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NC(=O)NCC4=CC=CS4

Isomeric SMILES

CN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NC(=O)NCC4=CC=CS4

InChI

InChI=1S/C20H17N3O3S/c1-23-16-6-2-3-7-18(16)26-17-9-8-13(11-15(17)19(23)24)22-20(25)21-12-14-5-4-10-27-14/h2-11H,12H2,1H3,(H2,21,22,25)