N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]pyridine-3-carboxamide

Systemtic Name: N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]pyridine-3-carboxamide Openeye Name: N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]pyridine-3-carboxamide CAS Name: N-[[[(1S)-1-(1-adamantyl)ethyl]amino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]pyridine-3-carboxamide Traditional Name: N-[[(1S)-1-(1-adamantyl)ethyl]thiocarbamoyl]nicotinamide Formula: C19H25N3OS MolecularWeight: 343.4863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=CN=CC=C4

Isomeric SMILES

C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C19H25N3OS/c1-12(19-8-13-5-14(9-19)7-15(6-13)10-19)21-18(24)22-17(23)16-3-2-4-20-11-16/h2-4,11-15H,5-10H2,1H3,(H2,21,22,23,24)/t12-,13?,14?,15?,19?/m0/s1