6-(1,3-benzothiazol-2-yl)-N-[3-(1-phenylethoxy)propyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: 6-(1,3-benzothiazol-2-yl)-N-[3-(1-phenylethoxy)propyl]cyclohex-3-ene-1-carboxamide Openeye Name: 6-(1,3-benzothiazol-2-yl)-N-[3-(1-phenylethoxy)propyl]cyclohex-3-ene-1-carboxamide CAS Name: 6-(1,3-benzothiazol-2-yl)-N-[3-(1-phenylethoxy)propyl]-1-cyclohex-3-enecarboxamide IUPAC Name: 6-(1,3-benzothiazol-2-yl)-N-[3-(1-phenylethoxy)propyl]cyclohex-3-ene-1-carboxamide Traditional Name: 6-(1,3-benzothiazol-2-yl)-N-[3-(1-phenylethoxy)propyl]cyclohex-3-ene-1-carboxamide Formula: C25H28N2O2S MolecularWeight: 420.56702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OCCCNC(=O)C2CC=CCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C1=CC=CC=C1)OCCCNC(=O)C2CC=CCC2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H28N2O2S/c1-18(19-10-3-2-4-11-19)29-17-9-16-26-24(28)20-12-5-6-13-21(20)25-27-22-14-7-8-15-23(22)30-25/h2-8,10-11,14-15,18,20-21H,9,12-13,16-17H2,1H3,(H,26,28)