[tert-butyl-[2-(pentanoylamino)thiophen-3-yl]amino] hydrogen carbonate

Systemtic Name: [tert-butyl-[2-(pentanoylamino)thiophen-3-yl]amino] hydrogen carbonate Openeye Name: [tert-butyl-[2-(pentanoylamino)-3-thienyl]amino] hydrogen carbonate CAS Name: carbonic acid [tert-butyl-[2-(1-oxopentylamino)-3-thiophenyl]amino] ester IUPAC Name: [tert-butyl-[2-(pentanoylamino)thiophen-3-yl]amino] hydrogen carbonate Traditional Name: carbonic acid [tert-butyl-[2-(valerylamino)-3-thienyl]amino] ester Formula: C14H22N2O4S MolecularWeight: 314.40048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=CS1)N(C(C)(C)C)OC(=O)O

Isomeric SMILES

CCCCC(=O)NC1=C(C=CS1)N(C(C)(C)C)OC(=O)O

InChI

InChI=1S/C14H22N2O4S/c1-5-6-7-11(17)15-12-10(8-9-21-12)16(14(2,3)4)20-13(18)19/h8-9H,5-7H2,1-4H3,(H,15,17)(H,18,19)