N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithian-2-yl)-N-methylbenzamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithian-2-yl)-N-methylbenzamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-(1,3-dithian-2-yl)-N-methyl-benzamide Formula: C21H22N2OS3 MolecularWeight: 414.60718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC=C(C=C3)C4SCCCS4

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C21H22N2OS3/c1-14(19-22-17-6-3-4-7-18(17)27-19)23(2)20(24)15-8-10-16(11-9-15)21-25-12-5-13-26-21/h3-4,6-11,14,21H,5,12-13H2,1-2H3/t14-/m1/s1