4-[[2-azanyl-6-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]amino]-N-(2-propan-2-ylphenyl)benzamide

Systemtic Name: 4-[[2-azanyl-6-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]amino]-N-(2-propan-2-ylphenyl)benzamide Openeye Name: 4-[[2-amino-6-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]amino]-N-(2-isopropylphenyl)benzamide CAS Name: 4-[[2-amino-6-(1,3-benzothiazol-6-ylamino)-4-pyrimidinyl]amino]-N-(2-propan-2-ylphenyl)benzamide IUPAC Name: 4-[[2-amino-6-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]amino]-N-(2-propan-2-ylphenyl)benzamide Traditional Name: 4-[[2-amino-6-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]amino]-N-o-cumenyl-benzamide Formula: C27H25N7OS MolecularWeight: 495.5987

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC3=CC(=NC(=N3)N)NC4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC3=CC(=NC(=N3)N)NC4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C27H25N7OS/c1-16(2)20-5-3-4-6-21(20)32-26(35)17-7-9-18(10-8-17)30-24-14-25(34-27(28)33-24)31-19-11-12-22-23(13-19)36-15-29-22/h3-16H,1-2H3,(H,32,35)(H4,28,30,31,33,34)