5-tert-butyl-N-methyl-3-[[4-[2-(1-oxidanylidenethiolan-3-yl)ethoxy]naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxamide

Systemtic Name: 5-tert-butyl-N-methyl-3-[[4-[2-(1-oxidanylidenethiolan-3-yl)ethoxy]naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxamide Openeye Name: 5-tert-butyl-N-methyl-3-[[4-[2-(1-oxothiolan-3-yl)ethoxy]-1-naphthyl]carbamoylamino]-1H-pyrrole-2-carboxamide CAS Name: 5-tert-butyl-N-methyl-3-[[oxo-[[4-[2-(1-oxo-3-thiolanyl)ethoxy]-1-naphthalenyl]amino]methyl]amino]-1H-pyrrole-2-carboxamide IUPAC Name: 5-tert-butyl-N-methyl-3-[[4-[2-(1-oxothiolan-3-yl)ethoxy]naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxamide Traditional Name: 5-tert-butyl-3-[[4-[2-(1-ketothiolan-3-yl)ethoxy]-1-naphthyl]carbamoylamino]-N-methyl-1H-pyrrole-2-carboxamide Formula: C27H34N4O4S MolecularWeight: 510.64826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(N1)C(=O)NC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCC4CCS(=O)C4

Isomeric SMILES

CC(C)(C)C1=CC(=C(N1)C(=O)NC)NC(=O)NC2=CC=C(C3=CC=CC=C32)OCCC4CCS(=O)C4

InChI

InChI=1S/C27H34N4O4S/c1-27(2,3)23-15-21(24(31-23)25(32)28-4)30-26(33)29-20-9-10-22(19-8-6-5-7-18(19)20)35-13-11-17-12-14-36(34)16-17/h5-10,15,17,31H,11-14,16H2,1-4H3,(H,28,32)(H2,29,30,33)