N-(1,3-benzothiazol-2-yl)-4-(phenylmethyl)sulfonyl-butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(phenylmethyl)sulfonyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfonyl-butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(phenylmethyl)sulfonylbutanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfonylbutanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-benzylsulfonyl-butyramide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2O3S2/c21-17(20-18-19-15-9-4-5-10-16(15)24-18)11-6-12-25(22,23)13-14-7-2-1-3-8-14/h1-5,7-10H,6,11-13H2,(H,19,20,21)