N-(4-aminophenyl)-2-[(4-aminophenyl)carbonylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(4-aminophenyl)-2-[(4-aminophenyl)carbonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(4-aminobenzoyl)amino]-N-(4-aminophenyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(4-aminophenyl)-2-[[(4-aminophenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(4-aminobenzoyl)amino]-N-(4-aminophenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(4-aminobenzoyl)amino]-N-(4-aminophenyl)-1,3-benzothiazole-6-carboxamide Formula: C21H17N5O2S MolecularWeight: 403.45698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC=C(C=C4)N)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC=C(C=C4)N)N

InChI

InChI=1S/C21H17N5O2S/c22-14-4-1-12(2-5-14)19(27)26-21-25-17-10-3-13(11-18(17)29-21)20(28)24-16-8-6-15(23)7-9-16/h1-11H,22-23H2,(H,24,28)(H,25,26,27)