1-acridin-9-yl-3-[6-(acridin-9-ylcarbamothioylamino)hexyl]thiourea

Systemtic Name: 1-acridin-9-yl-3-[6-(acridin-9-ylcarbamothioylamino)hexyl]thiourea Openeye Name: 1-acridin-9-yl-3-[6-(acridin-9-ylcarbamothioylamino)hexyl]thiourea CAS Name: 1-(9-acridinyl)-3-[6-[[(9-acridinylamino)-sulfanylidenemethyl]amino]hexyl]thiourea IUPAC Name: 1-acridin-9-yl-3-[6-(acridin-9-ylcarbamothioylamino)hexyl]thiourea Traditional Name: 1-acridin-9-yl-3-[6-(acridin-9-ylthiocarbamoylamino)hexyl]thiourea Formula: C34H32N6S2 MolecularWeight: 588.78808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC(=S)NCCCCCCNC(=S)NC4=C5C=CC=CC5=NC6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC(=S)NCCCCCCNC(=S)NC4=C5C=CC=CC5=NC6=CC=CC=C64

InChI

InChI=1S/C34H32N6S2/c41-33(39-31-23-13-3-7-17-27(23)37-28-18-8-4-14-24(28)31)35-21-11-1-2-12-22-36-34(42)40-32-25-15-5-9-19-29(25)38-30-20-10-6-16-26(30)32/h3-10,13-20H,1-2,11-12,21-22H2,(H2,35,37,39,41)(H2,36,38,40,42)