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

Systemtic Name: 1-(1-adamantyl)-3-[[2-(1-adamantylcarbamothioylhydrazinylidene)indol-3-yl]amino]thiourea Openeye Name: 1-(1-adamantyl)-3-[[3-[2-(1-adamantylcarbamothioyl)hydrazino]indol-2-ylidene]amino]thiourea CAS Name: 1-(1-adamantyl)-3-[[2-[[(1-adamantylamino)-sulfanylidenemethyl]hydrazinylidene]-3-indolyl]amino]thiourea IUPAC Name: 1-(1-adamantyl)-3-[[2-(1-adamantylcarbamothioylhydrazinylidene)indol-3-yl]amino]thiourea Traditional Name: 1-(1-adamantyl)-3-[[3-[N'-(1-adamantylthiocarbamoyl)hydrazino]indol-2-ylidene]amino]thiourea Formula: C30H39N7S2 MolecularWeight: 561.80756

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NNC4=C5C=CC=CC5=NC4=NNC(=S)NC67CC8CC(C6)CC(C8)C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NNC4=C5C=CC=CC5=NC4=NNC(=S)NC67CC8CC(C6)CC(C8)C7

InChI

InChI=1S/C30H39N7S2/c38-27(32-29-11-17-5-18(12-29)7-19(6-17)13-29)36-34-25-23-3-1-2-4-24(23)31-26(25)35-37-28(39)33-30-14-20-8-21(15-30)10-22(9-20)16-30/h1-4,17-22H,5-16H2,(H,31,34,35)(H2,32,36,38)(H2,33,37,39)