methyl N-[4-[[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]carbamoyl]phenyl]carbamate

Systemtic Name: methyl N-[4-[[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]carbamoyl]phenyl]carbamate Openeye Name: methyl N-[4-[[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]carbamoyl]phenyl]carbamate CAS Name: N-[4-[oxo-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]hydrazo]methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]carbamoyl]phenyl]carbamate Traditional Name: N-[4-[[(3-pyrrolidinosulfonylbenzoyl)amino]carbamoyl]phenyl]carbamic acid methyl ester Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H22N4O6S/c1-30-20(27)21-16-9-7-14(8-10-16)18(25)22-23-19(26)15-5-4-6-17(13-15)31(28,29)24-11-2-3-12-24/h4-10,13H,2-3,11-12H2,1H3,(H,21,27)(H,22,25)(H,23,26)