N'-[1-[(2-hexylphenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]thiophene-2-carboximidamide

Systemtic Name: N'-[1-[(2-hexylphenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]thiophene-2-carboximidamide Openeye Name: N'-[1-[(2-hexylphenyl)methylamino]indan-5-yl]thiophene-2-carboxamidine CAS Name: N'-[1-[(2-hexylphenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]-2-thiophenecarboximidamide IUPAC Name: N'-[1-[(2-hexylphenyl)methylamino]-2,3-dihydro-1H-inden-5-yl]thiophene-2-carboximidamide Traditional Name: N'-[1-[(2-hexylbenzyl)amino]indan-5-yl]thiophene-2-carboxamidine Formula: C27H33N3S MolecularWeight: 431.63602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC=C1CNC2CCC3=C2C=CC(=C3)N=C(C4=CC=CS4)N

Isomeric SMILES

CCCCCCC1=CC=CC=C1CNC2CCC3=C2C=CC(=C3)N=C(C4=CC=CS4)N

InChI

InChI=1S/C27H33N3S/c1-2-3-4-5-9-20-10-6-7-11-22(20)19-29-25-16-13-21-18-23(14-15-24(21)25)30-27(28)26-12-8-17-31-26/h6-8,10-12,14-15,17-18,25,29H,2-5,9,13,16,19H2,1H3,(H2,28,30)