tert-butyl N-[4-[4-(heptan-4-ylcarbamoylamino)phenyl]-1,3-thiazol-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[4-(heptan-4-ylcarbamoylamino)phenyl]-1,3-thiazol-2-yl]carbamate Openeye Name: tert-butyl N-[4-[4-(1-propylbutylcarbamoylamino)phenyl]thiazol-2-yl]carbamate CAS Name: N-[4-[4-[[(heptan-4-ylamino)-oxomethyl]amino]phenyl]-2-thiazolyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-(heptan-4-ylcarbamoylamino)phenyl]-1,3-thiazol-2-yl]carbamate Traditional Name: N-[4-[4-(1-propylbutylcarbamoylamino)phenyl]thiazol-2-yl]carbamic acid tert-butyl ester Formula: C22H32N4O3S MolecularWeight: 432.57948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(CCC)NC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H32N4O3S/c1-6-8-16(9-7-2)23-19(27)24-17-12-10-15(11-13-17)18-14-30-20(25-18)26-21(28)29-22(3,4)5/h10-14,16H,6-9H2,1-5H3,(H2,23,24,27)(H,25,26,28)