1-(2-adamantyl)-3-[(3,4-dichlorophenyl)methyl]thiourea

Systemtic Name: 1-(2-adamantyl)-3-[(3,4-dichlorophenyl)methyl]thiourea Openeye Name: 1-(2-adamantyl)-3-[(3,4-dichlorophenyl)methyl]thiourea CAS Name: 1-(2-adamantyl)-3-[(3,4-dichlorophenyl)methyl]thiourea IUPAC Name: 1-(2-adamantyl)-3-[(3,4-dichlorophenyl)methyl]thiourea Traditional Name: 1-(2-adamantyl)-3-(3,4-dichlorobenzyl)thiourea Formula: C18H22Cl2N2S MolecularWeight: 369.35168

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=S)NCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=S)NCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C18H22Cl2N2S/c19-15-2-1-10(8-16(15)20)9-21-18(23)22-17-13-4-11-3-12(6-13)7-14(17)5-11/h1-2,8,11-14,17H,3-7,9H2,(H2,21,22,23)