1,3-bis[4-(diethylamino)phenyl]-5-(2-methylheptan-2-yl)-1,3,5-triazinane-2-thione

Systemtic Name: 1,3-bis[4-(diethylamino)phenyl]-5-(2-methylheptan-2-yl)-1,3,5-triazinane-2-thione Openeye Name: 1,3-bis[4-(diethylamino)phenyl]-5-(1,1-dimethylhexyl)-1,3,5-triazinane-2-thione CAS Name: 1,3-bis[4-(diethylamino)phenyl]-5-(2-methylheptan-2-yl)-1,3,5-triazinane-2-thione IUPAC Name: 1,3-bis[4-(diethylamino)phenyl]-5-(2-methylheptan-2-yl)-1,3,5-triazinane-2-thione Traditional Name: 1,3-bis[4-(diethylamino)phenyl]-5-(1,1-dimethylhexyl)-1,3,5-triazinane-2-thione Formula: C31H49N5S MolecularWeight: 523.81926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)N1CN(C(=S)N(C1)C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC

Isomeric SMILES

CCCCCC(C)(C)N1CN(C(=S)N(C1)C2=CC=C(C=C2)N(CC)CC)C3=CC=C(C=C3)N(CC)CC

InChI

InChI=1S/C31H49N5S/c1-8-13-14-23-31(6,7)34-24-35(28-19-15-26(16-20-28)32(9-2)10-3)30(37)36(25-34)29-21-17-27(18-22-29)33(11-4)12-5/h15-22H,8-14,23-25H2,1-7H3