(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C19H16N2O2S3 MolecularWeight: 400.53754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)OCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)OCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C19H16N2O2S3/c22-18(7-3-6-17-21-15-4-1-2-5-16(15)26-17)23-10-14-12-25-19(20-14)13-8-9-24-11-13/h1-2,4-5,8-9,11-12H,3,6-7,10H2