2-methyl-6-[1-(phenylsulfonyl)pyrrol-3-yl]-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine

Systemtic Name: 2-methyl-6-[1-(phenylsulfonyl)pyrrol-3-yl]-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine Openeye Name: 6-[1-(benzenesulfonyl)pyrrol-3-yl]-2-methyl-4-(1-piperidyl)-5H-pyrrolo[3,2-d]pyrimidine CAS Name: 6-[1-(benzenesulfonyl)-3-pyrrolyl]-2-methyl-4-(1-piperidinyl)-5H-pyrrolo[3,2-d]pyrimidine IUPAC Name: 6-[1-(benzenesulfonyl)pyrrol-3-yl]-2-methyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine Traditional Name: 6-(1-besylpyrrol-3-yl)-2-methyl-4-piperidino-5H-pyrrolo[3,2-d]pyrimidine Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCCCC3)NC(=C2)C4=CN(C=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCCCC3)NC(=C2)C4=CN(C=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C22H23N5O2S/c1-16-23-20-14-19(25-21(20)22(24-16)26-11-6-3-7-12-26)17-10-13-27(15-17)30(28,29)18-8-4-2-5-9-18/h2,4-5,8-10,13-15,25H,3,6-7,11-12H2,1H3