2-[[4-[[4-(2-azanylethanoyl)piperazin-1-yl]methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile

Systemtic Name: 2-[[4-[[4-(2-azanylethanoyl)piperazin-1-yl]methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[[4-[[4-(2-aminoacetyl)piperazin-1-yl]methyl]-2-pyridyl]amino]thiazole-5-carbonitrile CAS Name: 2-[[4-[[4-(2-amino-1-oxoethyl)-1-piperazinyl]methyl]-2-pyridinyl]amino]-5-thiazolecarbonitrile IUPAC Name: 2-[[4-[[4-(2-aminoacetyl)piperazin-1-yl]methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[[4-[(4-glycylpiperazino)methyl]-2-pyridyl]amino]thiazole-5-carbonitrile Formula: C16H19N7OS MolecularWeight: 357.43336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=NC=C2)NC3=NC=C(S3)C#N)C(=O)CN

Isomeric SMILES

C1CN(CCN1CC2=CC(=NC=C2)NC3=NC=C(S3)C#N)C(=O)CN

InChI

InChI=1S/C16H19N7OS/c17-8-13-10-20-16(25-13)21-14-7-12(1-2-19-14)11-22-3-5-23(6-4-22)15(24)9-18/h1-2,7,10H,3-6,9,11,18H2,(H,19,20,21)