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

Systemtic Name: 2,5-bis(azanyl)-4-methyl-pyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile Openeye Name: 2,5-diamino-4-methyl-pyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile CAS Name: 2,5-diamino-4-methyl-3-pyrido[2,3-b][1,5]benzothiazepinecarbonitrile IUPAC Name: 2,5-diamino-4-methylpyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile Traditional Name: 2,5-diamino-4-methyl-pyrido[2,3-b][1,5]benzothiazepine-3-carbonitrile Formula: C14H11N5S MolecularWeight: 281.33564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C1C(=NC3=CC=CC=C3S2)N)N)C#N

Isomeric SMILES

CC1=C(C(=NC2=C1C(=NC3=CC=CC=C3S2)N)N)C#N

InChI

InChI=1S/C14H11N5S/c1-7-8(6-15)12(16)19-14-11(7)13(17)18-9-4-2-3-5-10(9)20-14/h2-5H,1H3,(H2,16,19)(H2,17,18)