3-acetamido-N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(2-thienyl)propionamide Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CC(C4=CC=CS4)NC(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CC(C4=CC=CS4)NC(=O)C

InChI

InChI=1S/C24H23N3O2S2/c1-3-17-10-12-18(13-11-17)27(24-26-19-7-4-5-8-22(19)31-24)23(29)15-20(25-16(2)28)21-9-6-14-30-21/h4-14,20H,3,15H2,1-2H3,(H,25,28)