[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl] 4-(1H-imidazol-2-yl)benzoate

Systemtic Name: [1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl] 4-(1H-imidazol-2-yl)benzoate Openeye Name: 1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]propyl 4-(1H-imidazol-2-yl)benzoate CAS Name: 4-(1H-imidazol-2-yl)benzoic acid [1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl] 4-(1H-imidazol-2-yl)benzoate Traditional Name: 4-(1H-imidazol-2-yl)benzoic acid 1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]propyl ester Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C4=NC=CN4

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C)OC(=O)C3=CC=C(C=C3)C4=NC=CN4

InChI

InChI=1S/C22H20N4O3S/c1-3-17(20(27)26-22-25-16-9-4-13(2)12-18(16)30-22)29-21(28)15-7-5-14(6-8-15)19-23-10-11-24-19/h4-12,17H,3H2,1-2H3,(H,23,24)(H,25,26,27)