N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]-5-methyl-1,3-thiazol-2-amine

Systemtic Name: N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]-5-methyl-1,3-thiazol-2-amine Openeye Name: N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(m-tolyl)pyrimidin-4-yl]-5-methyl-thiazol-2-amine CAS Name: N-[2-(1,3-benzothiazol-6-ylthio)-6-(3-methylphenyl)-4-pyrimidinyl]-5-methyl-2-thiazolamine IUPAC Name: N-[2-(1,3-benzothiazol-6-ylsulfanyl)-6-(3-methylphenyl)pyrimidin-4-yl]-5-methyl-1,3-thiazol-2-amine Traditional Name: [2-(1,3-benzothiazol-6-ylthio)-6-(m-tolyl)pyrimidin-4-yl]-(5-methylthiazol-2-yl)amine Formula: C22H17N5S3 MolecularWeight: 447.59888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=NC(=N2)SC3=CC4=C(C=C3)N=CS4)NC5=NC=C(S5)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=NC(=N2)SC3=CC4=C(C=C3)N=CS4)NC5=NC=C(S5)C

InChI

InChI=1S/C22H17N5S3/c1-13-4-3-5-15(8-13)18-10-20(26-21-23-11-14(2)29-21)27-22(25-18)30-16-6-7-17-19(9-16)28-12-24-17/h3-12H,1-2H3,(H,23,25,26,27)