1-(1-adamantylcarbonylamino)-3-(2-phenylsulfanylethyl)thiourea

Systemtic Name: 1-(1-adamantylcarbonylamino)-3-(2-phenylsulfanylethyl)thiourea Openeye Name: 1-(adamantane-1-carbonylamino)-3-(2-phenylsulfanylethyl)thiourea CAS Name: 1-[[1-adamantyl(oxo)methyl]amino]-3-[2-(phenylthio)ethyl]thiourea IUPAC Name: 1-(adamantane-1-carbonylamino)-3-(2-phenylsulfanylethyl)thiourea Traditional Name: 1-(adamantane-1-carbonylamino)-3-[2-(phenylthio)ethyl]thiourea Formula: C20H27N3OS2 MolecularWeight: 389.57788

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=S)NCCSC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NNC(=S)NCCSC4=CC=CC=C4

InChI

InChI=1S/C20H27N3OS2/c24-18(20-11-14-8-15(12-20)10-16(9-14)13-20)22-23-19(25)21-6-7-26-17-4-2-1-3-5-17/h1-5,14-16H,6-13H2,(H,22,24)(H2,21,23,25)