tert-butyl N-[[4-(phenylcarbonylcarbamothioylamino)cyclohexyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-(phenylcarbonylcarbamothioylamino)cyclohexyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-(benzoylcarbamothioylamino)cyclohexyl]methyl]carbamate CAS Name: N-[[4-[[benzamido(sulfanylidene)methyl]amino]cyclohexyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-(benzoylcarbamothioylamino)cyclohexyl]methyl]carbamate Traditional Name: N-[[4-(benzoylthiocarbamoylamino)cyclohexyl]methyl]carbamic acid tert-butyl ester Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CCC(CC1)NC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCC1CCC(CC1)NC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H29N3O3S/c1-20(2,3)26-19(25)21-13-14-9-11-16(12-10-14)22-18(27)23-17(24)15-7-5-4-6-8-15/h4-8,14,16H,9-13H2,1-3H3,(H,21,25)(H2,22,23,24,27)