N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H21N5O4S/c1-29-16-8-4-14(5-9-16)18-21-20(24-23-18)22-19(26)15-6-10-17(11-7-15)30(27,28)25-12-2-3-13-25/h4-11H,2-3,12-13H2,1H3,(H2,21,22,23,24,26)