2-[[6-(4-azanylazepan-1-yl)pyrimidin-4-yl]amino]-1,3-thiazole-5-carbonitrile

Systemtic Name: 2-[[6-(4-azanylazepan-1-yl)pyrimidin-4-yl]amino]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[[6-(4-aminoazepan-1-yl)pyrimidin-4-yl]amino]thiazole-5-carbonitrile CAS Name: 2-[[6-(4-amino-1-azepanyl)-4-pyrimidinyl]amino]-5-thiazolecarbonitrile IUPAC Name: 2-[[6-(4-aminoazepan-1-yl)pyrimidin-4-yl]amino]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[[6-(4-aminoazepan-1-yl)pyrimidin-4-yl]amino]thiazole-5-carbonitrile Formula: C14H17N7S MolecularWeight: 315.39668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)C2=CC(=NC=N2)NC3=NC=C(S3)C#N)N

Isomeric SMILES

C1CC(CCN(C1)C2=CC(=NC=N2)NC3=NC=C(S3)C#N)N

InChI

InChI=1S/C14H17N7S/c15-7-11-8-17-14(22-11)20-12-6-13(19-9-18-12)21-4-1-2-10(16)3-5-21/h6,8-10H,1-5,16H2,(H,17,18,19,20)