1-(1-adamantyl)-1-[[(3Z)-3-(1-adamantylcarbamothioylhydrazinylidene)indol-2-yl]amino]thiourea

Systemtic Name: 1-(1-adamantyl)-1-[[(3Z)-3-(1-adamantylcarbamothioylhydrazinylidene)indol-2-yl]amino]thiourea Openeye Name: 1-(1-adamantyl)-1-[[(3Z)-3-(1-adamantylcarbamothioylhydrazono)indol-2-yl]amino]thiourea CAS Name: 1-(1-adamantyl)-1-[[(3Z)-3-[[(1-adamantylamino)-sulfanylidenemethyl]hydrazinylidene]-2-indolyl]amino]thiourea IUPAC Name: 1-(1-adamantyl)-1-[[(3Z)-3-(1-adamantylcarbamothioylhydrazinylidene)indol-2-yl]amino]thiourea Traditional Name: 1-(1-adamantyl)-1-[[(3Z)-3-(1-adamantylthiocarbamoylhydrazono)indol-2-yl]amino]thiourea Formula: C30H39N7S2 MolecularWeight: 561.80756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NN=C4C5=CC=CC=C5N=C4NN(C(=S)N)C67CC8CC(C6)CC(C8)C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)N/N=C\4/C5=CC=CC=C5N=C4NN(C(=S)N)C67CC8CC(C6)CC(C8)C7

InChI

InChI=1S/C30H39N7S2/c31-27(38)37(30-14-20-8-21(15-30)10-22(9-20)16-30)36-26-25(23-3-1-2-4-24(23)32-26)34-35-28(39)33-29-11-17-5-18(12-29)7-19(6-17)13-29/h1-4,17-22H,5-16H2,(H2,31,38)(H,32,34,36)(H2,33,35,39)