N-[(5-chloranylthiophen-2-yl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-prop-2-enyl-propanamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-prop-2-enyl-propanamide Openeye Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-prop-2-enylpropanamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-prop-2-enylpropanamide Traditional Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C17H18ClN5O2S MolecularWeight: 391.87512

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(CC=C)CC3=CC=C(S3)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(CC=C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C17H18ClN5O2S/c1-3-7-22(10-12-4-5-14(18)26-12)15(24)6-8-23-11-19-16-13(17(23)25)9-20-21(16)2/h3-5,9,11H,1,6-8,10H2,2H3