(2S)-2-(aminocarbonylamino)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]propanamide

Systemtic Name: (2S)-2-(aminocarbonylamino)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]propanamide Openeye Name: (2S)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-yl-phenyl]-2-ureido-propanamide CAS Name: (2S)-2-(carbamoylamino)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-(1-pyrrolidinyl)phenyl]propanamide IUPAC Name: (2S)-2-(carbamoylamino)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidin-1-ylphenyl]propanamide Traditional Name: (2S)-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-pyrrolidino-phenyl]-2-ureido-propionamide Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)N2CCCC2)S(=O)(=O)NC3=CC=C(C=C3)OC)NC(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C=C1)N2CCCC2)S(=O)(=O)NC3=CC=C(C=C3)OC)NC(=O)N

InChI

InChI=1S/C21H27N5O5S/c1-14(23-21(22)28)20(27)24-16-7-10-18(26-11-3-4-12-26)19(13-16)32(29,30)25-15-5-8-17(31-2)9-6-15/h5-10,13-14,25H,3-4,11-12H2,1-2H3,(H,24,27)(H3,22,23,28)/t14-/m0/s1