1-tert-butyl-3-[(2Z)-2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-4H-1,4-benzothiazin-7-yl]urea

Systemtic Name: 1-tert-butyl-3-[(2Z)-2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-4H-1,4-benzothiazin-7-yl]urea Openeye Name: 1-tert-butyl-3-[(2Z)-2-(1H-indol-3-ylmethylene)-3-oxo-4H-1,4-benzothiazin-7-yl]urea CAS Name: 1-tert-butyl-3-[(2Z)-2-(1H-indol-3-ylmethylidene)-3-oxo-4H-1,4-benzothiazin-7-yl]urea IUPAC Name: 1-tert-butyl-3-[(2Z)-2-(1H-indol-3-ylmethylidene)-3-oxo-4H-1,4-benzothiazin-7-yl]urea Traditional Name: 1-tert-butyl-3-[(2Z)-2-(1H-indol-3-ylmethylene)-3-keto-4H-1,4-benzothiazin-7-yl]urea Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=CC2=C(C=C1)NC(=O)C(=CC3=CNC4=CC=CC=C43)S2

Isomeric SMILES

CC(C)(C)NC(=O)NC1=CC2=C(C=C1)NC(=O)/C(=C/C3=CNC4=CC=CC=C43)/S2

InChI

InChI=1S/C22H22N4O2S/c1-22(2,3)26-21(28)24-14-8-9-17-18(11-14)29-19(20(27)25-17)10-13-12-23-16-7-5-4-6-15(13)16/h4-12,23H,1-3H3,(H,25,27)(H2,24,26,28)/b19-10-