tert-butyl N-[4-[(pentylcarbamothioylamino)carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[(pentylcarbamothioylamino)carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[(pentylcarbamothioylamino)carbamoyl]phenyl]carbamate CAS Name: N-[4-[oxo-[[(pentylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[(pentylcarbamothioylamino)carbamoyl]phenyl]carbamate Traditional Name: N-[4-[(amylthiocarbamoylamino)carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C18H28N4O3S MolecularWeight: 380.50492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CC=C(C=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H28N4O3S/c1-5-6-7-12-19-16(26)22-21-15(23)13-8-10-14(11-9-13)20-17(24)25-18(2,3)4/h8-11H,5-7,12H2,1-4H3,(H,20,24)(H,21,23)(H2,19,22,26)