6-[1-(phenylmethyl)piperidin-4-yl]-1-prop-2-enyl-4-thiophen-3-yl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione

Systemtic Name: 6-[1-(phenylmethyl)piperidin-4-yl]-1-prop-2-enyl-4-thiophen-3-yl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 1-allyl-6-(1-benzyl-4-piperidyl)-4-(3-thienyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 6-[1-(phenylmethyl)-4-piperidinyl]-1-prop-2-enyl-4-(3-thiophenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 6-(1-benzylpiperidin-4-yl)-1-prop-2-enyl-4-thiophen-3-yl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 1-allyl-6-(1-benzyl-4-piperidyl)-4-(3-thienyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C(NC1=O)C3=CSC=C3)C(=O)N(C2)C4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C=CCN1C2=C(C(NC1=O)C3=CSC=C3)C(=O)N(C2)C4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H28N4O2S/c1-2-11-28-21-16-29(20-8-12-27(13-9-20)15-18-6-4-3-5-7-18)24(30)22(21)23(26-25(28)31)19-10-14-32-17-19/h2-7,10,14,17,20,23H,1,8-9,11-13,15-16H2,(H,26,31)