propan-2-yl 2,4-dimethyl-5-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 5-[4-[2-(allylamino)-2-oxo-ethyl]piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[4-[2-oxo-2-(prop-2-enylamino)ethyl]-1-piperazinyl]methyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-[4-[2-oxo-2-(prop-2-enylamino)ethyl]piperazine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[4-[2-(allylamino)-2-keto-ethyl]piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C20H30N4O4 MolecularWeight: 390.4766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)N2CCN(CC2)CC(=O)NCC=C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)N2CCN(CC2)CC(=O)NCC=C

InChI

InChI=1S/C20H30N4O4/c1-6-7-21-16(25)12-23-8-10-24(11-9-23)19(26)18-14(4)17(15(5)22-18)20(27)28-13(2)3/h6,13,22H,1,7-12H2,2-5H3,(H,21,25)