1-butan-2-yl-3-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)urea

Systemtic Name: 1-butan-2-yl-3-(5-methyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)urea Openeye Name: 1-(5-methyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)-3-sec-butyl-urea CAS Name: 1-butan-2-yl-3-(5-methyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)urea IUPAC Name: 1-butan-2-yl-3-(5-methyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)urea Traditional Name: 1-(6-keto-5-methyl-benzo[b][1,4]benzothiazepin-3-yl)-3-sec-butyl-urea Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CCC(C)NC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C19H21N3O2S/c1-4-12(2)20-19(24)21-13-9-10-17-15(11-13)22(3)18(23)14-7-5-6-8-16(14)25-17/h5-12H,4H2,1-3H3,(H2,20,21,24)