N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]propionamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)CCN2C=NC3=C(C2=O)C=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)CCN2C=NC3=C(C2=O)C=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2S/c1-16-17(14-27(25-16)18-7-3-2-4-8-18)6-5-11-23-20(28)9-12-26-15-24-21-19(22(26)29)10-13-30-21/h2-4,7-8,10,13-15H,5-6,9,11-12H2,1H3,(H,23,28)