ethyl 3-(4-chlorophenyl)-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoate

Systemtic Name: ethyl 3-(4-chlorophenyl)-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoate Openeye Name: ethyl 3-(4-chlorophenyl)-2-[(6-isopropyl-1,3-benzothiazol-2-yl)amino]propanoate CAS Name: 3-(4-chlorophenyl)-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorophenyl)-2-[(6-propan-2-yl-1,3-benzothiazol-2-yl)amino]propanoate Traditional Name: 3-(4-chlorophenyl)-2-[(6-isopropyl-1,3-benzothiazol-2-yl)amino]propionic acid ethyl ester Formula: C21H23ClN2O2S MolecularWeight: 402.93752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)Cl)NC2=NC3=C(S2)C=C(C=C3)C(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)Cl)NC2=NC3=C(S2)C=C(C=C3)C(C)C

InChI

InChI=1S/C21H23ClN2O2S/c1-4-26-20(25)18(11-14-5-8-16(22)9-6-14)24-21-23-17-10-7-15(13(2)3)12-19(17)27-21/h5-10,12-13,18H,4,11H2,1-3H3,(H,23,24)