ethyl 3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-3-oxidanylidene-2-(phenylmethyl)propanoate

Systemtic Name: ethyl 3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-3-oxidanylidene-2-(phenylmethyl)propanoate Openeye Name: ethyl 2-benzyl-3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-3-oxo-propanoate CAS Name: 3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-3-oxo-2-(phenylmethyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-benzyl-3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-3-oxopropanoate Traditional Name: 2-benzyl-3-keto-3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]propionic acid ethyl ester Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C26H24N2O3S/c1-3-31-26(30)21(16-18-7-5-4-6-8-18)24(29)27-20-12-10-19(11-13-20)25-28-22-14-9-17(2)15-23(22)32-25/h4-15,21H,3,16H2,1-2H3,(H,27,29)