N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-2,6-dimethoxy-benzamide Openeye Name: N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: N-[[[(1R)-1-(1-adamantyl)ethyl]amino]-sulfanylidenemethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[[(1R)-1-(1-adamantyl)ethyl]carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[[(1R)-1-(1-adamantyl)ethyl]thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=C(C=CC=C4OC)OC

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=C(C=CC=C4OC)OC

InChI

InChI=1S/C22H30N2O3S/c1-13(22-10-14-7-15(11-22)9-16(8-14)12-22)23-21(28)24-20(25)19-17(26-2)5-4-6-18(19)27-3/h4-6,13-16H,7-12H2,1-3H3,(H2,23,24,25,28)/t13-,14?,15?,16?,22?/m1/s1