3-chloranyl-N-phenyl-N-[[(1S,4R)-4,7,7-trimethyl-3-piperidin-1-yl-2-bicyclo[2.2.1]hept-2-enyl]carbothioyl]benzamide

Systemtic Name: 3-chloranyl-N-phenyl-N-[[(1S,4R)-4,7,7-trimethyl-3-piperidin-1-yl-2-bicyclo[2.2.1]hept-2-enyl]carbothioyl]benzamide Openeye Name: 3-chloro-N-phenyl-N-[(1S,4R)-4,7,7-trimethyl-3-(1-piperidyl)bicyclo[2.2.1]hept-2-ene-2-carbothioyl]benzamide CAS Name: 3-chloro-N-phenyl-N-[sulfanylidene-[(1S,4R)-4,7,7-trimethyl-3-(1-piperidinyl)-2-bicyclo[2.2.1]hept-2-enyl]methyl]benzamide IUPAC Name: 3-chloro-N-phenyl-N-[(1S,4R)-4,7,7-trimethyl-3-piperidin-1-ylbicyclo[2.2.1]hept-2-ene-2-carbothioyl]benzamide Traditional Name: 3-chloro-N-phenyl-N-[(1S,4R)-4,7,7-trimethyl-3-piperidino-bicyclo[2.2.1]hept-2-ene-2-carbothioyl]benzamide Formula: C29H33ClN2OS MolecularWeight: 493.10312

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=C2C(=S)N(C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Cl)N5CCCCC5)C)C

Isomeric SMILES

C[C@@]12CC[C@@H](C1(C)C)C(=C2N3CCCCC3)C(=S)N(C4=CC=CC=C4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C29H33ClN2OS/c1-28(2)23-15-16-29(28,3)25(31-17-8-5-9-18-31)24(23)27(34)32(22-13-6-4-7-14-22)26(33)20-11-10-12-21(30)19-20/h4,6-7,10-14,19,23H,5,8-9,15-18H2,1-3H3/t23-,29+/m1/s1