1-(4-cyanophenyl)-3-[6-[(4-cyanophenyl)carbamothioylamino]hexyl]thiourea

Systemtic Name: 1-(4-cyanophenyl)-3-[6-[(4-cyanophenyl)carbamothioylamino]hexyl]thiourea Openeye Name: 1-(4-cyanophenyl)-3-[6-[(4-cyanophenyl)carbamothioylamino]hexyl]thiourea CAS Name: 1-[6-[[(4-cyanoanilino)-sulfanylidenemethyl]amino]hexyl]-3-(4-cyanophenyl)thiourea IUPAC Name: 1-(4-cyanophenyl)-3-[6-[(4-cyanophenyl)carbamothioylamino]hexyl]thiourea Traditional Name: 1-(4-cyanophenyl)-3-[6-[(4-cyanophenyl)thiocarbamoylamino]hexyl]thiourea Formula: C22H24N6S2 MolecularWeight: 436.59616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=S)NCCCCCCNC(=S)NC2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=S)NCCCCCCNC(=S)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H24N6S2/c23-15-17-5-9-19(10-6-17)27-21(29)25-13-3-1-2-4-14-26-22(30)28-20-11-7-18(16-24)8-12-20/h5-12H,1-4,13-14H2,(H2,25,27,29)(H2,26,28,30)