(1S)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: (1S)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]cyclohex-3-ene-1-carboxamide Openeye Name: (1S)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]cyclohex-3-ene-1-carboxamide CAS Name: (1S)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-cyclohex-3-enecarboxamide IUPAC Name: (1S)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]cyclohex-3-ene-1-carboxamide Traditional Name: (1S)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]cyclohex-3-ene-1-carboxamide Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N2OS/c24-21(16-6-2-1-3-7-16)22-17-12-10-15(11-13-17)14-20-23-18-8-4-5-9-19(18)25-20/h1-2,4-5,8-13,16H,3,6-7,14H2,(H,22,24)/t16-/m1/s1