2-azanyl-1-(phenylcarbonyl)pyrrolo[2,1-b][1,3]benzothiazole-3-carbonitrile

Systemtic Name: 2-azanyl-1-(phenylcarbonyl)pyrrolo[2,1-b][1,3]benzothiazole-3-carbonitrile Openeye Name: 2-amino-1-benzoyl-pyrrolo[2,1-b][1,3]benzothiazole-3-carbonitrile CAS Name: 2-amino-1-benzoyl-3-pyrrolo[2,1-b][1,3]benzothiazolecarbonitrile IUPAC Name: 2-amino-1-benzoylpyrrolo[2,1-b][1,3]benzothiazole-3-carbonitrile Traditional Name: 2-amino-1-benzoyl-pyrrolo[2,1-b][1,3]benzothiazole-3-carbonitrile Formula: C18H11N3OS MolecularWeight: 317.36444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C(=C3N2C4=CC=CC=C4S3)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C(=C3N2C4=CC=CC=C4S3)C#N)N

InChI

InChI=1S/C18H11N3OS/c19-10-12-15(20)16(17(22)11-6-2-1-3-7-11)21-13-8-4-5-9-14(13)23-18(12)21/h1-9H,20H2