2-[[1-(2-oxidanylidene-2-piperazin-1-yl-ethyl)pyrrolo[3,2-c]pyridin-4-yl]amino]-1,3-thiazole-5-carbonitrile

Systemtic Name: 2-[[1-(2-oxidanylidene-2-piperazin-1-yl-ethyl)pyrrolo[3,2-c]pyridin-4-yl]amino]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[[1-(2-oxo-2-piperazin-1-yl-ethyl)pyrrolo[3,2-c]pyridin-4-yl]amino]thiazole-5-carbonitrile CAS Name: 2-[[1-[2-oxo-2-(1-piperazinyl)ethyl]-4-pyrrolo[3,2-c]pyridinyl]amino]-5-thiazolecarbonitrile IUPAC Name: 2-[[1-(2-oxo-2-piperazin-1-ylethyl)pyrrolo[3,2-c]pyridin-4-yl]amino]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[[1-(2-keto-2-piperazino-ethyl)pyrrolo[3,2-c]pyridin-4-yl]amino]thiazole-5-carbonitrile Formula: C17H17N7OS MolecularWeight: 367.42818

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)CN2C=CC3=C2C=CN=C3NC4=NC=C(S4)C#N

Isomeric SMILES

C1CN(CCN1)C(=O)CN2C=CC3=C2C=CN=C3NC4=NC=C(S4)C#N

InChI

InChI=1S/C17H17N7OS/c18-9-12-10-21-17(26-12)22-16-13-2-6-24(14(13)1-3-20-16)11-15(25)23-7-4-19-5-8-23/h1-3,6,10,19H,4-5,7-8,11H2,(H,20,21,22)