4-[4-methyl-2-(propylamino)-1,3-thiazol-5-yl]-2-[(3-piperazin-1-ylcarbonylphenyl)amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-[4-methyl-2-(propylamino)-1,3-thiazol-5-yl]-2-[(3-piperazin-1-ylcarbonylphenyl)amino]pyrimidine-5-carbonitrile Openeye Name: 4-[4-methyl-2-(propylamino)thiazol-5-yl]-2-[3-(piperazine-1-carbonyl)anilino]pyrimidine-5-carbonitrile CAS Name: 4-[4-methyl-2-(propylamino)-5-thiazolyl]-2-[3-[oxo(1-piperazinyl)methyl]anilino]-5-pyrimidinecarbonitrile IUPAC Name: 4-[4-methyl-2-(propylamino)-1,3-thiazol-5-yl]-2-[3-(piperazine-1-carbonyl)anilino]pyrimidine-5-carbonitrile Traditional Name: 4-[4-methyl-2-(propylamino)thiazol-5-yl]-2-[3-(piperazine-1-carbonyl)anilino]pyrimidine-5-carbonitrile Formula: C23H26N8OS MolecularWeight: 462.57054

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=C(S1)C2=NC(=NC=C2C#N)NC3=CC=CC(=C3)C(=O)N4CCNCC4)C

Isomeric SMILES

CCCNC1=NC(=C(S1)C2=NC(=NC=C2C#N)NC3=CC=CC(=C3)C(=O)N4CCNCC4)C

InChI

InChI=1S/C23H26N8OS/c1-3-7-26-23-28-15(2)20(33-23)19-17(13-24)14-27-22(30-19)29-18-6-4-5-16(12-18)21(32)31-10-8-25-9-11-31/h4-6,12,14,25H,3,7-11H2,1-2H3,(H,26,28)(H,27,29,30)