4,4-bis(4-dimethylaminophenyl)-2-phenyl-N,N-bis(phenylmethyl)-3,1-benzothiazin-5-amine

Systemtic Name: 4,4-bis(4-dimethylaminophenyl)-2-phenyl-N,N-bis(phenylmethyl)-3,1-benzothiazin-5-amine Openeye Name: N,N-dibenzyl-4,4-bis(4-dimethylaminophenyl)-2-phenyl-3,1-benzothiazin-5-amine CAS Name: 4,4-bis(4-dimethylaminophenyl)-2-phenyl-N,N-bis(phenylmethyl)-3,1-benzothiazin-5-amine IUPAC Name: N,N-dibenzyl-4,4-bis(4-dimethylaminophenyl)-2-phenyl-3,1-benzothiazin-5-amine Traditional Name: dibenzyl-[4,4-bis(4-dimethylaminophenyl)-2-phenyl-3,1-benzothiazin-5-yl]amine Formula: C44H42N4S MolecularWeight: 658.89608

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2(C3=C(C=CC=C3N(CC4=CC=CC=C4)CC5=CC=CC=C5)N=C(S2)C6=CC=CC=C6)C7=CC=C(C=C7)N(C)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2(C3=C(C=CC=C3N(CC4=CC=CC=C4)CC5=CC=CC=C5)N=C(S2)C6=CC=CC=C6)C7=CC=C(C=C7)N(C)C

InChI

InChI=1S/C44H42N4S/c1-46(2)38-27-23-36(24-28-38)44(37-25-29-39(30-26-37)47(3)4)42-40(45-43(49-44)35-19-12-7-13-20-35)21-14-22-41(42)48(31-33-15-8-5-9-16-33)32-34-17-10-6-11-18-34/h5-30H,31-32H2,1-4H3