2-[[3-[(4-ethanoylpiperazin-1-yl)methyl]phenyl]amino]-1,3-thiazole-5-carbonitrile

Systemtic Name: 2-[[3-[(4-ethanoylpiperazin-1-yl)methyl]phenyl]amino]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[3-[(4-acetylpiperazin-1-yl)methyl]anilino]thiazole-5-carbonitrile CAS Name: 2-[3-[(4-acetyl-1-piperazinyl)methyl]anilino]-5-thiazolecarbonitrile IUPAC Name: 2-[3-[(4-acetylpiperazin-1-yl)methyl]anilino]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[3-[(4-acetylpiperazino)methyl]anilino]thiazole-5-carbonitrile Formula: C17H19N5OS MolecularWeight: 341.43066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=CC(=CC=C2)NC3=NC=C(S3)C#N

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=CC(=CC=C2)NC3=NC=C(S3)C#N

InChI

InChI=1S/C17H19N5OS/c1-13(23)22-7-5-21(6-8-22)12-14-3-2-4-15(9-14)20-17-19-11-16(10-18)24-17/h2-4,9,11H,5-8,12H2,1H3,(H,19,20)