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

Systemtic Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-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(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

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

InChI

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