(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-(diphenylmethyl)piperazine-1-carbodithioate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-(diphenylmethyl)piperazine-1-carbodithioate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-benzhydrylpiperazine-1-carbodithioate CAS Name: 4-(diphenylmethyl)-1-piperazinecarbodithioic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-benzhydrylpiperazine-1-carbodithioate Traditional Name: 4-benzhydrylpiperazine-1-carbodithioic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C28H29N7S2 MolecularWeight: 527.70676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)SCC4=NC(=NC(=N4)NC5=CC=CC=C5)N

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=S)SCC4=NC(=NC(=N4)NC5=CC=CC=C5)N

InChI

InChI=1S/C28H29N7S2/c29-26-31-24(32-27(33-26)30-23-14-8-3-9-15-23)20-37-28(36)35-18-16-34(17-19-35)25(21-10-4-1-5-11-21)22-12-6-2-7-13-22/h1-15,25H,16-20H2,(H3,29,30,31,32,33)