(4Z)-N4,N5-dimethyl-3,6-bis(4-methylphenyl)-N4,N5-diphenyl-2,7-bis(phenylimino)-1,8-dithia-3,6-diazacyclotetradec-4-ene-4,5-diamine

Systemtic Name: (4Z)-N4,N5-dimethyl-3,6-bis(4-methylphenyl)-N4,N5-diphenyl-2,7-bis(phenylimino)-1,8-dithia-3,6-diazacyclotetradec-4-ene-4,5-diamine Openeye Name: (4Z)-N4,N5-dimethyl-N4,N5-diphenyl-2,7-bis(phenylimino)-3,6-bis(p-tolyl)-1,8-dithia-3,6-diazacyclotetradec-4-ene-4,5-diamine CAS Name: (4Z)-N4,N5-dimethyl-3,6-bis(4-methylphenyl)-N4,N5-diphenyl-2,7-bis(phenylimino)-1,8-dithia-3,6-diazacyclotetradec-4-ene-4,5-diamine IUPAC Name: (4Z)-4-N,5-N-dimethyl-3,6-bis(4-methylphenyl)-4-N,5-N-diphenyl-2,7-bis(phenylimino)-1,8-dithia-3,6-diazacyclotetradec-4-ene-4,5-diamine Traditional Name: methyl-[(4Z)-5-(N-methylanilino)-2,7-bis(phenylimino)-3,6-bis(p-tolyl)-1,8-dithia-3,6-diazacyclotetradec-4-en-4-yl]-phenyl-amine Formula: C50H52N6S2 MolecularWeight: 801.11808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(N(C(=NC3=CC=CC=C3)SCCCCCCSC2=NC4=CC=CC=C4)C5=CC=C(C=C5)C)N(C)C6=CC=CC=C6)N(C)C7=CC=CC=C7

Isomeric SMILES

CC1=CC=C(C=C1)N2/C(=C(\N(C(=NC3=CC=CC=C3)SCCCCCCSC2=NC4=CC=CC=C4)C5=CC=C(C=C5)C)/N(C)C6=CC=CC=C6)/N(C)C7=CC=CC=C7

InChI

InChI=1S/C50H52N6S2/c1-39-29-33-45(34-30-39)55-47(53(3)43-25-15-9-16-26-43)48(54(4)44-27-17-10-18-28-44)56(46-35-31-40(2)32-36-46)50(52-42-23-13-8-14-24-42)58-38-20-6-5-19-37-57-49(55)51-41-21-11-7-12-22-41/h7-18,21-36H,5-6,19-20,37-38H2,1-4H3/b48-47-,51-49?,52-50?