ethyl 3-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-(3-chlorobenzothiophene-2-carbonyl)amino]propanoate CAS Name: 3-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-(3-chloro-1-benzothiophene-2-carbonyl)amino]propanoate Traditional Name: 3-[benzyl-(3-chlorobenzothiophene-2-carbonyl)amino]propionic acid ethyl ester Formula: C21H20ClNO3S MolecularWeight: 401.9064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C21H20ClNO3S/c1-2-26-18(24)12-13-23(14-15-8-4-3-5-9-15)21(25)20-19(22)16-10-6-7-11-17(16)27-20/h3-11H,2,12-14H2,1H3