methyl 4-[(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate

Systemtic Name: methyl 4-[(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Openeye Name: methyl 4-[(6-isopropyl-3-propyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate CAS Name: 4-[oxo-[(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Traditional Name: 4-[(6-isopropyl-3-propyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoic acid methyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O3S/c1-5-12-24-18-11-10-17(14(2)3)13-19(18)28-22(24)23-20(25)15-6-8-16(9-7-15)21(26)27-4/h6-11,13-14H,5,12H2,1-4H3