methyl 4-[(4-chloranyl-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate

Systemtic Name: methyl 4-[(4-chloranyl-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Openeye Name: methyl 4-[(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate CAS Name: 4-[[(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Traditional Name: 4-[(4-chloro-3-methyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoic acid methyl ester Formula: C17H13ClN2O3S MolecularWeight: 360.81472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC=C2Cl)SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN1C2=C(C=CC=C2Cl)SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C17H13ClN2O3S/c1-20-14-12(18)4-3-5-13(14)24-17(20)19-15(21)10-6-8-11(9-7-10)16(22)23-2/h3-9H,1-2H3