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

Systemtic Name: 2-[[4-[[2-methoxyethyl-(phenylmethyl)amino]methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[[4-[[benzyl(2-methoxyethyl)amino]methyl]-2-pyridyl]amino]thiazole-5-carbonitrile CAS Name: 2-[[4-[[2-methoxyethyl-(phenylmethyl)amino]methyl]-2-pyridinyl]amino]-5-thiazolecarbonitrile IUPAC Name: 2-[[4-[[benzyl(2-methoxyethyl)amino]methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[[4-[[benzyl(2-methoxyethyl)amino]methyl]-2-pyridyl]amino]thiazole-5-carbonitrile Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=CC=C1)CC2=CC(=NC=C2)NC3=NC=C(S3)C#N

Isomeric SMILES

COCCN(CC1=CC=CC=C1)CC2=CC(=NC=C2)NC3=NC=C(S3)C#N

InChI

InChI=1S/C20H21N5OS/c1-26-10-9-25(14-16-5-3-2-4-6-16)15-17-7-8-22-19(11-17)24-20-23-13-18(12-21)27-20/h2-8,11,13H,9-10,14-15H2,1H3,(H,22,23,24)