N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenyl-propyl]benzothiophene-2-carboxamide CAS Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-keto-1-phenyl-propyl]benzothiophene-2-carboxamide Formula: C25H21N5O3S MolecularWeight: 471.53094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)NC2=CC3=C(C=C2)N=C(N3)N)O)NC(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)NC2=CC3=C(C=C2)N=C(N3)N)O)NC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C25H21N5O3S/c26-25-28-17-11-10-16(13-18(17)29-25)27-24(33)22(31)21(14-6-2-1-3-7-14)30-23(32)20-12-15-8-4-5-9-19(15)34-20/h1-13,21-22,31H,(H,27,33)(H,30,32)(H3,26,28,29)