N-cyclopropyl-4-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-cyclopropyl-4-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-cyclopropyl-4-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-cyclopropyl-4-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-cyclopropyl-4-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-cyclopropyl-4-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3COC4=CC=CC=C4O3)C(=O)NC5CC5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC[C@H]3COC4=CC=CC=C4O3)C(=O)NC5CC5

InChI

InChI=1S/C20H20N4O3S/c1-11-16-18(21-8-13-9-26-14-4-2-3-5-15(14)27-13)22-10-23-20(16)28-17(11)19(25)24-12-6-7-12/h2-5,10,12-13H,6-9H2,1H3,(H,24,25)(H,21,22,23)/t13-/m0/s1