1-(1-adamantyl)-3-[(3-chloranyl-2-methyl-phenyl)amino]thiourea

Systemtic Name: 1-(1-adamantyl)-3-[(3-chloranyl-2-methyl-phenyl)amino]thiourea Openeye Name: 1-(1-adamantyl)-3-(3-chloro-2-methyl-anilino)thiourea CAS Name: 1-(1-adamantyl)-3-(3-chloro-2-methylanilino)thiourea IUPAC Name: 1-(1-adamantyl)-3-(3-chloro-2-methylanilino)thiourea Traditional Name: 1-(1-adamantyl)-3-(3-chloro-2-methyl-anilino)thiourea Formula: C18H24ClN3S MolecularWeight: 349.92126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NNC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NNC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H24ClN3S/c1-11-15(19)3-2-4-16(11)21-22-17(23)20-18-8-12-5-13(9-18)7-14(6-12)10-18/h2-4,12-14,21H,5-10H2,1H3,(H2,20,22,23)