N-[4-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-4-oxidanylidene-butyl]-2-ethoxy-benzamide

Systemtic Name: N-[4-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-4-oxidanylidene-butyl]-2-ethoxy-benzamide Openeye Name: N-[4-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-4-oxo-butyl]-2-ethoxy-benzamide CAS Name: N-[4-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methylamino]-4-oxobutyl]-2-ethoxybenzamide IUPAC Name: N-[4-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methylamino]-4-oxobutyl]-2-ethoxybenzamide Traditional Name: N-[4-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]-4-keto-butyl]-2-ethoxy-benzamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NCCCC(=O)N(C)C(C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NCCCC(=O)N(C)[C@H](C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C23H27N3O3S/c1-4-29-19-12-7-5-10-17(19)22(28)24-15-9-14-21(27)26(3)16(2)23-25-18-11-6-8-13-20(18)30-23/h5-8,10-13,16H,4,9,14-15H2,1-3H3,(H,24,28)/t16-/m1/s1