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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NCC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCC(=O)NCC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

InChI

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