methyl 4-[[5-chloranyl-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate

Systemtic Name: methyl 4-[[5-chloranyl-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate Openeye Name: methyl 4-[[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate CAS Name: 4-[[[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoate Traditional Name: 4-[[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]carbamoyl]benzoic acid methyl ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=NC(=O)C3=CC=C(C=C3)C(=O)OC)S2)CCOC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=NC(=O)C3=CC=C(C=C3)C(=O)OC)S2)CCOC)Cl

InChI

InChI=1S/C20H19ClN2O4S/c1-12-15(21)8-9-16-17(12)23(10-11-26-2)20(28-16)22-18(24)13-4-6-14(7-5-13)19(25)27-3/h4-9H,10-11H2,1-3H3