2,5-bis(azanyl)-4-phenyl-pyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile

Systemtic Name: 2,5-bis(azanyl)-4-phenyl-pyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile Openeye Name: 2,5-diamino-4-phenyl-pyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile CAS Name: 2,5-diamino-4-phenyl-3-pyrido[2,3-b][1,5]benzothiazepinecarbonitrile IUPAC Name: 2,5-diamino-4-phenylpyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile Traditional Name: 2,5-diamino-4-phenyl-pyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile Formula: C19H13N5S MolecularWeight: 343.40502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC3=C2C(=NC4=CC=CC=C4S3)N)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC3=C2C(=NC4=CC=CC=C4S3)N)N)C#N

InChI

InChI=1S/C19H13N5S/c20-10-12-15(11-6-2-1-3-7-11)16-18(22)23-13-8-4-5-9-14(13)25-19(16)24-17(12)21/h1-9H,(H2,21,24)(H2,22,23)