N-[1-(1-azanylethenyl)-2-ethoxy-piperidin-3-yl]-2-[6-oxidanylidene-5-[(phenylmethyl)sulfonylamino]pyrimidin-1-yl]ethanamide

Systemtic Name: N-[1-(1-azanylethenyl)-2-ethoxy-piperidin-3-yl]-2-[6-oxidanylidene-5-[(phenylmethyl)sulfonylamino]pyrimidin-1-yl]ethanamide Openeye Name: N-[1-(1-aminovinyl)-2-ethoxy-3-piperidyl]-2-[5-(benzylsulfonylamino)-6-oxo-pyrimidin-1-yl]acetamide CAS Name: N-[1-(1-aminoethenyl)-2-ethoxy-3-piperidinyl]-2-[6-oxo-5-[(phenylmethyl)sulfonylamino]-1-pyrimidinyl]acetamide IUPAC Name: N-[1-(1-aminoethenyl)-2-ethoxypiperidin-3-yl]-2-[5-(benzylsulfonylamino)-6-oxopyrimidin-1-yl]acetamide Traditional Name: N-[1-(1-aminovinyl)-2-ethoxy-3-piperidyl]-2-[5-(benzylsulfonylamino)-6-keto-pyrimidin-1-yl]acetamide Formula: C22H30N6O5S MolecularWeight: 490.5758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(CCCN1C(=C)N)NC(=O)CN2C=NC=C(C2=O)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC1C(CCCN1C(=C)N)NC(=O)CN2C=NC=C(C2=O)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N6O5S/c1-3-33-22-18(10-7-11-28(22)16(2)23)25-20(29)13-27-15-24-12-19(21(27)30)26-34(31,32)14-17-8-5-4-6-9-17/h4-6,8-9,12,15,18,22,26H,2-3,7,10-11,13-14,23H2,1H3,(H,25,29)