N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-N-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-N-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-N-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-N-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-N-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-cyclopropyl-N-ethyl-4,5-dimethyl-N-piperonyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(C4=C(N=C(N=C4S3)C5CC5)C)C

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(C4=C(N=C(N=C4S3)C5CC5)C)C

InChI

InChI=1S/C22H23N3O3S/c1-4-25(10-14-5-8-16-17(9-14)28-11-27-16)22(26)19-12(2)18-13(3)23-20(15-6-7-15)24-21(18)29-19/h5,8-9,15H,4,6-7,10-11H2,1-3H3