6-butylsulfonyl-2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

Systemtic Name: 6-butylsulfonyl-2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Openeye Name: 6-butylsulfonyl-2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine CAS Name: 6-butylsulfonyl-2-phenyl-4-(1-pyrrolidinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine IUPAC Name: 6-butylsulfonyl-2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Traditional Name: 6-butylsulfonyl-2-phenyl-4-pyrrolidino-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CCCCS(=O)(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C21H28N4O2S/c1-2-3-15-28(26,27)25-14-11-19-18(16-25)21(24-12-7-8-13-24)23-20(22-19)17-9-5-4-6-10-17/h4-6,9-10H,2-3,7-8,11-16H2,1H3