2-[4-[(octan-4-ylamino)methyl]thiophen-3-yl]benzene-1,4-diamine

Systemtic Name: 2-[4-[(octan-4-ylamino)methyl]thiophen-3-yl]benzene-1,4-diamine Openeye Name: 2-[4-[(1-propylpentylamino)methyl]-3-thienyl]benzene-1,4-diamine CAS Name: 2-[4-[(octan-4-ylamino)methyl]-3-thiophenyl]benzene-1,4-diamine IUPAC Name: 2-[4-[(octan-4-ylamino)methyl]thiophen-3-yl]benzene-1,4-diamine Traditional Name: [4-(2,5-diaminophenyl)-3-thienyl]methyl-(1-propylpentyl)amine Formula: C19H29N3S MolecularWeight: 331.51866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)NCC1=CSC=C1C2=C(C=CC(=C2)N)N

Isomeric SMILES

CCCCC(CCC)NCC1=CSC=C1C2=C(C=CC(=C2)N)N

InChI

InChI=1S/C19H29N3S/c1-3-5-7-16(6-4-2)22-11-14-12-23-13-18(14)17-10-15(20)8-9-19(17)21/h8-10,12-13,16,22H,3-7,11,20-21H2,1-2H3