1-[(2S)-6-methylheptan-2-yl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea

Systemtic Name: 1-[(2S)-6-methylheptan-2-yl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea Openeye Name: 1-[(1S)-1,5-dimethylhexyl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea CAS Name: 1-[(2S)-6-methylheptan-2-yl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea IUPAC Name: 1-[(2S)-6-methylheptan-2-yl]-3-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]thiourea Traditional Name: 1-[(1S)-1,5-dimethylhexyl]-3-[(Z)-1-(4-mesylphenyl)ethylideneamino]thiourea Formula: C18H29N3O2S2 MolecularWeight: 383.57176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=S)NN=C(C)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=S)N/N=C(/C)\C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C18H29N3O2S2/c1-13(2)7-6-8-14(3)19-18(24)21-20-15(4)16-9-11-17(12-10-16)25(5,22)23/h9-14H,6-8H2,1-5H3,(H2,19,21,24)/b20-15-/t14-/m0/s1