1-(1-adamantyl)-3-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]thiourea

Systemtic Name: 1-(1-adamantyl)-3-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]thiourea Openeye Name: 1-(1-adamantyl)-3-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]thiourea CAS Name: 1-(1-adamantyl)-3-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]thiourea IUPAC Name: 1-(1-adamantyl)-3-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]thiourea Traditional Name: 1-(1-adamantyl)-3-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]thiourea Formula: C19H23Cl2N3S MolecularWeight: 396.37702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC12CC3CC(C1)CC(C3)C2)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C/C(=N\NC(=S)NC12CC3CC(C1)CC(C3)C2)/C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C19H23Cl2N3S/c1-11(15-2-3-16(20)17(21)7-15)23-24-18(25)22-19-8-12-4-13(9-19)6-14(5-12)10-19/h2-3,7,12-14H,4-6,8-10H2,1H3,(H2,22,24,25)/b23-11+