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

Systemtic Name: methyl 3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: methyl 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-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-3-oxopropanoate Traditional Name: 3-keto-3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]propionic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CC(=O)OC

InChI

InChI=1S/C18H16N2O3S/c1-11-3-8-14-15(9-11)24-18(20-14)12-4-6-13(7-5-12)19-16(21)10-17(22)23-2/h3-9H,10H2,1-2H3,(H,19,21)