[3-[benzamido(tert-butyl)carbamoyl]phenyl]methyl thiocyanate

Systemtic Name: [3-[benzamido(tert-butyl)carbamoyl]phenyl]methyl thiocyanate Openeye Name: [3-[benzamido(tert-butyl)carbamoyl]phenyl]methyl thiocyanate CAS Name: thiocyanic acid [3-[[benzamido(tert-butyl)amino]-oxomethyl]phenyl]methyl ester IUPAC Name: [3-[benzamido(tert-butyl)carbamoyl]phenyl]methyl thiocyanate Traditional Name: thiocyanic acid [3-[benzamido(tert-butyl)carbamoyl]benzyl] ester Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C(=O)C1=CC(=CC=C1)CSC#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)N(C(=O)C1=CC(=CC=C1)CSC#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21N3O2S/c1-20(2,3)23(22-18(24)16-9-5-4-6-10-16)19(25)17-11-7-8-15(12-17)13-26-14-21/h4-12H,13H2,1-3H3,(H,22,24)