1-azanyl-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-azanyl-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-(3-phenyl-2,1-benzoxazol-5-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-(3-phenylanthranil-5-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C32H18N6OS MolecularWeight: 534.58992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C4=C(C5=NC6=CC=CC=C6N5C(=C4C7=NC8=CC=CC=C8S7)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C4=C(C5=NC6=CC=CC=C6N5C(=C4C7=NC8=CC=CC=C8S7)N)C#N

InChI

InChI=1S/C32H18N6OS/c33-17-21-27(19-14-15-22-20(16-19)29(39-37-22)18-8-2-1-3-9-18)28(32-36-24-11-5-7-13-26(24)40-32)30(34)38-25-12-6-4-10-23(25)35-31(21)38/h1-16H,34H2