4-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]butyramide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)CCCC2=NC3=CC=CC=C3S2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)NC(=O)CCCC2=NC3=CC=CC=C3S2)OCC

InChI

InChI=1S/C23H28N2O3S/c1-4-27-19-14-13-17(15-20(19)28-5-2)16(3)24-22(26)11-8-12-23-25-18-9-6-7-10-21(18)29-23/h6-7,9-10,13-16H,4-5,8,11-12H2,1-3H3,(H,24,26)/t16-/m0/s1