N-(3-chlorophenyl)-2-(cyanoamino)-6-(3-methyl-4H-1,4-benzothiazin-2-yl)pyrimidine-4-carboxamide

Systemtic Name: N-(3-chlorophenyl)-2-(cyanoamino)-6-(3-methyl-4H-1,4-benzothiazin-2-yl)pyrimidine-4-carboxamide Openeye Name: N-(3-chlorophenyl)-2-(cyanoamino)-6-(3-methyl-4H-1,4-benzothiazin-2-yl)pyrimidine-4-carboxamide CAS Name: N-(3-chlorophenyl)-2-(cyanoamino)-6-(3-methyl-4H-1,4-benzothiazin-2-yl)-4-pyrimidinecarboxamide IUPAC Name: N-(3-chlorophenyl)-2-(cyanoamino)-6-(3-methyl-4H-1,4-benzothiazin-2-yl)pyrimidine-4-carboxamide Traditional Name: N-(3-chlorophenyl)-2-(cyanoamino)-6-(3-methyl-4H-1,4-benzothiazin-2-yl)pyrimidine-4-carboxamide Formula: C21H15ClN6OS MolecularWeight: 434.9014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C2N1)C3=CC(=NC(=N3)NC#N)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(SC2=CC=CC=C2N1)C3=CC(=NC(=N3)NC#N)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H15ClN6OS/c1-12-19(30-18-8-3-2-7-15(18)25-12)16-10-17(28-21(27-16)24-11-23)20(29)26-14-6-4-5-13(22)9-14/h2-10,25H,1H3,(H,26,29)(H,24,27,28)