1-ethyl-3-[[(5R,7R)-3-[2-(methylcarbamothioylamino)ethyl]-1-adamantyl]methyl]thiourea

Systemtic Name: 1-ethyl-3-[[(5R,7R)-3-[2-(methylcarbamothioylamino)ethyl]-1-adamantyl]methyl]thiourea Openeye Name: 1-ethyl-3-[[(5R,7R)-3-[2-(methylcarbamothioylamino)ethyl]-1-adamantyl]methyl]thiourea CAS Name: 1-ethyl-3-[[(5R,7R)-3-[2-[[methylamino(sulfanylidene)methyl]amino]ethyl]-1-adamantyl]methyl]thiourea IUPAC Name: 1-ethyl-3-[[(5R,7R)-3-[2-(methylcarbamothioylamino)ethyl]-1-adamantyl]methyl]thiourea Traditional Name: 1-ethyl-3-[[(5R,7R)-3-[2-(methylthiocarbamoylamino)ethyl]-1-adamantyl]methyl]thiourea Formula: C18H32N4S2 MolecularWeight: 368.60348

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC12CC3CC(C1)CC(C3)(C2)CCNC(=S)NC

Isomeric SMILES

CCNC(=S)NCC12C[C@@H]3C[C@@H](C1)CC(C3)(C2)CCNC(=S)NC

InChI

InChI=1S/C18H32N4S2/c1-3-20-16(24)22-12-18-9-13-6-14(10-18)8-17(7-13,11-18)4-5-21-15(23)19-2/h13-14H,3-12H2,1-2H3,(H2,19,21,23)(H2,20,22,24)/t13-,14-,17?,18?/m1/s1