(3S)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-butanamide

Systemtic Name: (3S)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-butanamide Openeye Name: (3S)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-butanamide CAS Name: (3S)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenylbutanamide IUPAC Name: (3S)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenylbutanamide Traditional Name: (3S)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-phenyl-butyramide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2OS/c1-12-7-6-10-15-17(12)20-18(22-15)19-16(21)11-13(2)14-8-4-3-5-9-14/h3-10,13H,11H2,1-2H3,(H,19,20,21)/t13-/m0/s1