N-[(3S)-1-carbamimidoyl-2-oxidanyl-piperidin-3-yl]-2-[2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]pyridin-1-yl]ethanamide

Systemtic Name: N-[(3S)-1-carbamimidoyl-2-oxidanyl-piperidin-3-yl]-2-[2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]pyridin-1-yl]ethanamide Openeye Name: 2-[3-(benzylsulfonylamino)-2-oxo-1-pyridyl]-N-[(3S)-1-carbamimidoyl-2-hydroxy-3-piperidyl]acetamide CAS Name: N-[(3S)-1-carbamimidoyl-2-hydroxy-3-piperidinyl]-2-[2-oxo-3-[(phenylmethyl)sulfonylamino]-1-pyridinyl]acetamide IUPAC Name: 2-[3-(benzylsulfonylamino)-2-oxopyridin-1-yl]-N-[(3S)-1-carbamimidoyl-2-hydroxypiperidin-3-yl]acetamide Traditional Name: N-[(3S)-1-amidino-2-hydroxy-3-piperidyl]-2-[3-(benzylsulfonylamino)-2-keto-1-pyridyl]acetamide Formula: C20H26N6O5S MolecularWeight: 462.52264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N(C1)C(=N)N)O)NC(=O)CN2C=CC=C(C2=O)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C(N(C1)C(=N)N)O)NC(=O)CN2C=CC=C(C2=O)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N6O5S/c21-20(22)26-11-5-8-15(19(26)29)23-17(27)12-25-10-4-9-16(18(25)28)24-32(30,31)13-14-6-2-1-3-7-14/h1-4,6-7,9-10,15,19,24,29H,5,8,11-13H2,(H3,21,22)(H,23,27)/t15-,19?/m0/s1