[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 4-methylbenzoate

Systemtic Name: [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 4-methylbenzoate Openeye Name: [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] ester IUPAC Name: [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-(6-methyl-1,3-benzothiazol-2-yl)phenyl] ester Formula: C22H17NO2S MolecularWeight: 359.44088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C22H17NO2S/c1-14-3-6-17(7-4-14)22(24)25-18-10-8-16(9-11-18)21-23-19-12-5-15(2)13-20(19)26-21/h3-13H,1-2H3