N-[(1R)-1-(1-adamantyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C22H30N2S MolecularWeight: 354.552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=S)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C22H30N2S/c1-15(22-11-16-8-17(12-22)10-18(9-16)13-22)23-21(25)24-7-6-19-4-2-3-5-20(19)14-24/h2-5,15-18H,6-14H2,1H3,(H,23,25)/t15-,16?,17?,18?,22?/m1/s1