tert-butyl N-[4-[[3-(2,3-dihydro-1H-inden-5-ylcarbamoyl)pyridin-2-yl]sulfanylmethyl]pyridin-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[[3-(2,3-dihydro-1H-inden-5-ylcarbamoyl)pyridin-2-yl]sulfanylmethyl]pyridin-2-yl]carbamate Openeye Name: tert-butyl N-[4-[[3-(indan-5-ylcarbamoyl)-2-pyridyl]sulfanylmethyl]-2-pyridyl]carbamate CAS Name: N-[4-[[[3-[(2,3-dihydro-1H-inden-5-ylamino)-oxomethyl]-2-pyridinyl]thio]methyl]-2-pyridinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[3-(2,3-dihydro-1H-inden-5-ylcarbamoyl)pyridin-2-yl]sulfanylmethyl]pyridin-2-yl]carbamate Traditional Name: N-[4-[[[3-(indan-5-ylcarbamoyl)-2-pyridyl]thio]methyl]-2-pyridyl]carbamic acid tert-butyl ester Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)NC3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)NC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C26H28N4O3S/c1-26(2,3)33-25(32)30-22-14-17(11-13-27-22)16-34-24-21(8-5-12-28-24)23(31)29-20-10-9-18-6-4-7-19(18)15-20/h5,8-15H,4,6-7,16H2,1-3H3,(H,29,31)(H,27,30,32)