4-propoxy-N-prop-2-ynyl-2-(7H-purin-8-yl)benzenesulfonamide

Systemtic Name: 4-propoxy-N-prop-2-ynyl-2-(7H-purin-8-yl)benzenesulfonamide Openeye Name: 4-propoxy-N-prop-2-ynyl-2-(7H-purin-8-yl)benzenesulfonamide CAS Name: 4-propoxy-N-prop-2-ynyl-2-(7H-purin-8-yl)benzenesulfonamide IUPAC Name: 4-propoxy-N-prop-2-ynyl-2-(7H-purin-8-yl)benzenesulfonamide Traditional Name: N-propargyl-4-propoxy-2-(7H-purin-8-yl)benzenesulfonamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)S(=O)(=O)NCC#C)C2=NC3=NC=NC=C3N2

Isomeric SMILES

CCCOC1=CC(=C(C=C1)S(=O)(=O)NCC#C)C2=NC3=NC=NC=C3N2

InChI

InChI=1S/C17H17N5O3S/c1-3-7-20-26(23,24)15-6-5-12(25-8-4-2)9-13(15)16-21-14-10-18-11-19-17(14)22-16/h1,5-6,9-11,20H,4,7-8H2,2H3,(H,18,19,21,22)