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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-(phenylmethyl)sulfonyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-4-benzylsulfonyl-butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-(phenylmethyl)sulfonylbutanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-4-benzylsulfonylbutanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-benzyl-4-benzylsulfonyl-butyramide Formula: C25H24N2O3S2 MolecularWeight: 464.59966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=NC3=CC=CC=C3S2)C(=O)CCCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=NC3=CC=CC=C3S2)C(=O)CCCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H24N2O3S2/c28-24(16-9-17-32(29,30)19-21-12-5-2-6-13-21)27(18-20-10-3-1-4-11-20)25-26-22-14-7-8-15-23(22)31-25/h1-8,10-15H,9,16-19H2