3-(aminomethyl)-3,5,5-trimethyl-cyclohexan-1-amine; 1,3-bis(4-chlorophenyl)thiourea

Systemtic Name: 3-(aminomethyl)-3,5,5-trimethyl-cyclohexan-1-amine; 1,3-bis(4-chlorophenyl)thiourea Openeye Name: 3-(aminomethyl)-3,5,5-trimethyl-cyclohexanamine; 1,3-bis(4-chlorophenyl)thiourea CAS Name: 3-(aminomethyl)-3,5,5-trimethyl-1-cyclohexanamine; 1,3-bis(4-chlorophenyl)thiourea IUPAC Name: 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine; 1,3-bis(4-chlorophenyl)thiourea Traditional Name: [3-(aminomethyl)-3,5,5-trimethyl-cyclohexyl]amine; 1,3-bis(4-chlorophenyl)thiourea Formula: C23H32Cl2N4S MolecularWeight: 467.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)CN)N)C.C1=CC(=CC=C1NC(=S)NC2=CC=C(C=C2)Cl)Cl

Isomeric SMILES

CC1(CC(CC(C1)(C)CN)N)C.C1=CC(=CC=C1NC(=S)NC2=CC=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H10Cl2N2S.C10H22N2/c14-9-1-5-11(6-2-9)16-13(18)17-12-7-3-10(15)4-8-12;1-9(2)4-8(12)5-10(3,6-9)7-11/h1-8H,(H2,16,17,18);8H,4-7,11-12H2,1-3H3