N,5-dimethyl-N-(1,2-oxazol-3-ylmethyl)-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N,5-dimethyl-N-(1,2-oxazol-3-ylmethyl)-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(isoxazol-3-ylmethyl)-N,5-dimethyl-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-isoxazolylmethyl)-N,5-dimethyl-4-(3-phenylpropylamino)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N,5-dimethyl-N-(1,2-oxazol-3-ylmethyl)-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(isoxazol-3-ylmethyl)-N,5-dimethyl-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCCC3=CC=CC=C3)C(=O)N(C)CC4=NOC=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCCC3=CC=CC=C3)C(=O)N(C)CC4=NOC=C4

InChI

InChI=1S/C22H23N5O2S/c1-15-18-20(23-11-6-9-16-7-4-3-5-8-16)24-14-25-21(18)30-19(15)22(28)27(2)13-17-10-12-29-26-17/h3-5,7-8,10,12,14H,6,9,11,13H2,1-2H3,(H,23,24,25)