methyl 5-tert-butyl-3-[[4-(2-pyridin-4-ylethyl)naphthalen-1-yl]carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[[4-(2-pyridin-4-ylethyl)naphthalen-1-yl]carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[[4-[2-(4-pyridyl)ethyl]-1-naphthyl]carbamoylamino]thiophene-2-carboxylate CAS Name: 5-tert-butyl-3-[[oxo-[[4-(2-pyridin-4-ylethyl)-1-naphthalenyl]amino]methyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[[4-(2-pyridin-4-ylethyl)naphthalen-1-yl]carbamoylamino]thiophene-2-carboxylate Traditional Name: 5-tert-butyl-3-[[4-[2-(4-pyridyl)ethyl]-1-naphthyl]carbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)CCC4=CC=NC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)CCC4=CC=NC=C4

InChI

InChI=1S/C28H29N3O3S/c1-28(2,3)24-17-23(25(35-24)26(32)34-4)31-27(33)30-22-12-11-19(20-7-5-6-8-21(20)22)10-9-18-13-15-29-16-14-18/h5-8,11-17H,9-10H2,1-4H3,(H2,30,31,33)