5-decyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazole-3-thiolate; tris(phenylmethyl)stannanylium

Systemtic Name: 5-decyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazole-3-thiolate; tris(phenylmethyl)stannanylium Openeye Name: 5-decyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazole-3-thiolate; tribenzylstannanylium CAS Name: 5-decyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazole-3-thiolate; tris(phenylmethyl)stannanylium IUPAC Name: 5-decyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazole-3-thiolate; tribenzylstannanylium Traditional Name: 5-decyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)-1,2,4-triazole-3-thiolate; tribenzylstannanylium Formula: C41H55N5S2Sn MolecularWeight: 800.7489

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=NN=C(N1C2=NN=C(S2)CCCCCC)[S-].C1=CC=C(C=C1)C[Sn+](CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCC1=NN=C(N1C2=NN=C(S2)CCCCCC)[S-].C1=CC=C(C=C1)C[Sn+](CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H35N5S2.3C7H7.Sn/c1-3-5-7-9-10-11-12-13-15-17-21-23-19(26)25(17)20-24-22-18(27-20)16-14-8-6-4-2;3*1-7-5-3-2-4-6-7;/h3-16H2,1-2H3,(H,23,26);3*2-6H,1H2;/q;;;;+1/p-1