methyl 5-tert-butyl-1-methyl-3-[[4-[2-(1-oxidanylidene-1,4-thiazinan-4-yl)ethoxy]naphthalen-1-yl]carbamoylamino]pyrrole-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-1-methyl-3-[[4-[2-(1-oxidanylidene-1,4-thiazinan-4-yl)ethoxy]naphthalen-1-yl]carbamoylamino]pyrrole-2-carboxylate Openeye Name: methyl 5-tert-butyl-1-methyl-3-[[4-[2-(1-oxo-1,4-thiazinan-4-yl)ethoxy]-1-naphthyl]carbamoylamino]pyrrole-2-carboxylate CAS Name: 5-tert-butyl-1-methyl-3-[[oxo-[[4-[2-(1-oxo-1,4-thiazinan-4-yl)ethoxy]-1-naphthalenyl]amino]methyl]amino]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-1-methyl-3-[[4-[2-(1-oxo-1,4-thiazinan-4-yl)ethoxy]naphthalen-1-yl]carbamoylamino]pyrrole-2-carboxylate Traditional Name: 5-tert-butyl-3-[[4-[2-(1-keto-1,4-thiazinan-4-yl)ethoxy]-1-naphthyl]carbamoylamino]-1-methyl-pyrrole-2-carboxylic acid methyl ester Formula: C28H36N4O5S MolecularWeight: 540.67424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(N1C)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCN4CCS(=O)CC4

Isomeric SMILES

CC(C)(C)C1=CC(=C(N1C)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCN4CCS(=O)CC4

InChI

InChI=1S/C28H36N4O5S/c1-28(2,3)24-18-22(25(31(24)4)26(33)36-5)30-27(34)29-21-10-11-23(20-9-7-6-8-19(20)21)37-15-12-32-13-16-38(35)17-14-32/h6-11,18H,12-17H2,1-5H3,(H2,29,30,34)