N-[2-[3-[(4-aminophenyl)carbonylamino]phenyl]-1,3-benzothiazol-6-yl]-4-azanyl-benzamide

Systemtic Name: N-[2-[3-[(4-aminophenyl)carbonylamino]phenyl]-1,3-benzothiazol-6-yl]-4-azanyl-benzamide Openeye Name: 4-amino-N-[2-[3-[(4-aminobenzoyl)amino]phenyl]-1,3-benzothiazol-6-yl]benzamide CAS Name: 4-amino-N-[2-[3-[[(4-aminophenyl)-oxomethyl]amino]phenyl]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 4-amino-N-[2-[3-[(4-aminobenzoyl)amino]phenyl]-1,3-benzothiazol-6-yl]benzamide Traditional Name: 4-amino-N-[2-[3-[(4-aminobenzoyl)amino]phenyl]-1,3-benzothiazol-6-yl]benzamide Formula: C27H21N5O2S MolecularWeight: 479.55294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N)C3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=C(C=C5)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N)C3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=C(C=C5)N

InChI

InChI=1S/C27H21N5O2S/c28-19-8-4-16(5-9-19)25(33)30-21-3-1-2-18(14-21)27-32-23-13-12-22(15-24(23)35-27)31-26(34)17-6-10-20(29)11-7-17/h1-15H,28-29H2,(H,30,33)(H,31,34)