tert-butyl N-[4-[[3-[(4-tert-butylphenyl)carbamoyl]pyridin-2-yl]sulfanylmethyl]pyridin-2-yl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[4-[[3-[(4-tert-butylphenyl)carbamoyl]pyridin-2-yl]sulfanylmethyl]pyridin-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[4-[[3-[(4-tert-butylphenyl)carbamoyl]-2-pyridyl]sulfanylmethyl]-2-pyridyl]-N-methyl-carbamate CAS Name: N-[4-[[[3-[(4-tert-butylanilino)-oxomethyl]-2-pyridinyl]thio]methyl]-2-pyridinyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[3-[(4-tert-butylphenyl)carbamoyl]pyridin-2-yl]sulfanylmethyl]pyridin-2-yl]-N-methylcarbamate Traditional Name: N-[4-[[[3-[(4-tert-butylphenyl)carbamoyl]-2-pyridyl]thio]methyl]-2-pyridyl]-N-methyl-carbamic acid tert-butyl ester Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)N(C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)N(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H34N4O3S/c1-27(2,3)20-10-12-21(13-11-20)31-24(33)22-9-8-15-30-25(22)36-18-19-14-16-29-23(17-19)32(7)26(34)35-28(4,5)6/h8-17H,18H2,1-7H3,(H,31,33)