1,3-benzodioxol-5-yl-[4-(2-cyclopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(2-cyclopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(2-cyclopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(2-cyclopropyl-5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(2-cyclopropyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(2-cyclopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)piperazino]methanone Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5)C6CC6)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCO5)C6CC6)C

InChI

InChI=1S/C23H24N4O3S/c1-13-14(2)31-22-19(13)21(24-20(25-22)15-3-4-15)26-7-9-27(10-8-26)23(28)16-5-6-17-18(11-16)30-12-29-17/h5-6,11,15H,3-4,7-10,12H2,1-2H3