methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)carbamoyl]benzoate Openeye Name: methyl 4-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate CAS Name: 4-[[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoate Traditional Name: 4-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid methyl ester Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C24H20N2O4S/c1-29-19-12-13-20-21(14-19)31-24(25-20)26(15-16-6-4-3-5-7-16)22(27)17-8-10-18(11-9-17)23(28)30-2/h3-14H,15H2,1-2H3