tert-butyl 3-[2-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]phenoxy]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-[4-aminocarbonyl-5-(aminocarbonylamino)thiophen-2-yl]phenoxy]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[2-(4-carbamoyl-5-ureido-2-thienyl)phenoxy]pyrrolidine-1-carboxylate CAS Name: 3-[2-[4-carbamoyl-5-(carbamoylamino)-2-thiophenyl]phenoxy]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[4-carbamoyl-5-(carbamoylamino)thiophen-2-yl]phenoxy]pyrrolidine-1-carboxylate Traditional Name: 3-[2-(4-carbamoyl-5-ureido-2-thienyl)phenoxy]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)OC2=CC=CC=C2C3=CC(=C(S3)NC(=O)N)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)OC2=CC=CC=C2C3=CC(=C(S3)NC(=O)N)C(=O)N

InChI

InChI=1S/C21H26N4O5S/c1-21(2,3)30-20(28)25-9-8-12(11-25)29-15-7-5-4-6-13(15)16-10-14(17(22)26)18(31-16)24-19(23)27/h4-7,10,12H,8-9,11H2,1-3H3,(H2,22,26)(H3,23,24,27)