N1,N2-bis(prop-1-ynyl)-N1,N2-bis(4-pyridin-4-ylsulfanylbutyl)benzene-1,2-diamine

Systemtic Name: N1,N2-bis(prop-1-ynyl)-N1,N2-bis(4-pyridin-4-ylsulfanylbutyl)benzene-1,2-diamine Openeye Name: N1,N2-bis(prop-1-ynyl)-N1,N2-bis[4-(4-pyridylsulfanyl)butyl]benzene-1,2-diamine CAS Name: N1,N2-bis(prop-1-ynyl)-N1,N2-bis[4-(pyridin-4-ylthio)butyl]benzene-1,2-diamine IUPAC Name: 1-N,2-N-bis(prop-1-ynyl)-1-N,2-N-bis(4-pyridin-4-ylsulfanylbutyl)benzene-1,2-diamine Traditional Name: prop-1-ynyl-[2-[prop-1-ynyl-[4-(4-pyridylthio)butyl]amino]phenyl]-[4-(4-pyridylthio)butyl]amine Formula: C30H34N4S2 MolecularWeight: 514.74776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CN(CCCCSC1=CC=NC=C1)C2=CC=CC=C2N(CCCCSC3=CC=NC=C3)C#CC

Isomeric SMILES

CC#CN(CCCCSC1=CC=NC=C1)C2=CC=CC=C2N(CCCCSC3=CC=NC=C3)C#CC

InChI

InChI=1S/C30H34N4S2/c1-3-21-33(23-7-9-25-35-27-13-17-31-18-14-27)29-11-5-6-12-30(29)34(22-4-2)24-8-10-26-36-28-15-19-32-20-16-28/h5-6,11-20H,7-10,23-26H2,1-2H3