N-(3-azanyl-3-oxidanylidene-propyl)-4-prop-2-ynoxy-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(3-azanyl-3-oxidanylidene-propyl)-4-prop-2-ynoxy-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(3-amino-3-oxo-propyl)-4-prop-2-ynoxy-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(3-amino-3-oxopropyl)-4-prop-2-ynoxy-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(3-amino-3-oxopropyl)-4-prop-2-ynoxy-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(3-amino-3-keto-propyl)-4-propargyloxy-1-(2-thienylsulfonyl)pipecolinamide Formula: C16H21N3O5S2 MolecularWeight: 399.48504

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1CCN(C(C1)C(=O)NCCC(=O)N)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

C#CCOC1CCN(C(C1)C(=O)NCCC(=O)N)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C16H21N3O5S2/c1-2-9-24-12-6-8-19(26(22,23)15-4-3-10-25-15)13(11-12)16(21)18-7-5-14(17)20/h1,3-4,10,12-13H,5-9,11H2,(H2,17,20)(H,18,21)