ethyl 3-[[5-oxidanylidene-1-[1-(thiophen-2-ylmethylamino)naphthalen-2-yl]pyrrolidin-3-yl]carbonylamino]-3-pyridin-3-yl-propanoate

Systemtic Name: ethyl 3-[[5-oxidanylidene-1-[1-(thiophen-2-ylmethylamino)naphthalen-2-yl]pyrrolidin-3-yl]carbonylamino]-3-pyridin-3-yl-propanoate Openeye Name: ethyl 3-[[5-oxo-1-[1-(2-thienylmethylamino)-2-naphthyl]pyrrolidine-3-carbonyl]amino]-3-(3-pyridyl)propanoate CAS Name: 3-[[oxo-[5-oxo-1-[1-(thiophen-2-ylmethylamino)-2-naphthalenyl]-3-pyrrolidinyl]methyl]amino]-3-(3-pyridinyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[[5-oxo-1-[1-(thiophen-2-ylmethylamino)naphthalen-2-yl]pyrrolidine-3-carbonyl]amino]-3-pyridin-3-ylpropanoate Traditional Name: 3-[[5-keto-1-[1-(2-thenylamino)-2-naphthyl]pyrrolidine-3-carbonyl]amino]-3-(3-pyridyl)propionic acid ethyl ester Formula: C30H30N4O4S MolecularWeight: 542.6486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CN=CC=C1)NC(=O)C2CC(=O)N(C2)C3=C(C4=CC=CC=C4C=C3)NCC5=CC=CS5

Isomeric SMILES

CCOC(=O)CC(C1=CN=CC=C1)NC(=O)C2CC(=O)N(C2)C3=C(C4=CC=CC=C4C=C3)NCC5=CC=CS5

InChI

InChI=1S/C30H30N4O4S/c1-2-38-28(36)16-25(21-8-5-13-31-17-21)33-30(37)22-15-27(35)34(19-22)26-12-11-20-7-3-4-10-24(20)29(26)32-18-23-9-6-14-39-23/h3-14,17,22,25,32H,2,15-16,18-19H2,1H3,(H,33,37)