2-(1,2,4-triazin-3-ylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(1,2,4-triazin-3-ylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(1,2,4-triazin-3-ylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-(1,2,4-triazin-3-ylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(1,2,4-triazin-3-ylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-mesityl-2-(1,2,4-triazin-3-ylamino)-1,3-benzothiazole-6-carboxamide Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC4=NC=CN=N4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC4=NC=CN=N4)C

InChI

InChI=1S/C20H18N6OS/c1-11-8-12(2)17(13(3)9-11)24-18(27)14-4-5-15-16(10-14)28-20(23-15)25-19-21-6-7-22-26-19/h4-10H,1-3H3,(H,24,27)(H,21,23,25,26)