2-[5-[2-carbamimidoyl-3-(pyridin-3-ylmethyl)phenyl]thiophen-2-yl]-6-(pyridin-3-ylmethyl)benzenecarboximidamide

Systemtic Name: 2-[5-[2-carbamimidoyl-3-(pyridin-3-ylmethyl)phenyl]thiophen-2-yl]-6-(pyridin-3-ylmethyl)benzenecarboximidamide Openeye Name: 2-[5-[2-carbamimidoyl-3-(3-pyridylmethyl)phenyl]-2-thienyl]-6-(3-pyridylmethyl)benzamidine CAS Name: 2-[5-[2-carbamimidoyl-3-(3-pyridinylmethyl)phenyl]-2-thiophenyl]-6-(3-pyridinylmethyl)benzenecarboximidamide IUPAC Name: 2-[5-[2-carbamimidoyl-3-(pyridin-3-ylmethyl)phenyl]thiophen-2-yl]-6-(pyridin-3-ylmethyl)benzenecarboximidamide Traditional Name: 2-[5-[2-amidino-3-(3-pyridylmethyl)phenyl]-2-thienyl]-6-(3-pyridylmethyl)benzamidine Formula: C30H26N6S MolecularWeight: 502.63264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CC2=CN=CC=C2)C(=N)N)C3=CC=C(S3)C4=C(C(=CC=C4)CC5=CN=CC=C5)C(=N)N

Isomeric SMILES

C1=CC(=C(C(=C1)CC2=CN=CC=C2)C(=N)N)C3=CC=C(S3)C4=C(C(=CC=C4)CC5=CN=CC=C5)C(=N)N

InChI

InChI=1S/C30H26N6S/c31-29(32)27-21(15-19-5-3-13-35-17-19)7-1-9-23(27)25-11-12-26(37-25)24-10-2-8-22(28(24)30(33)34)16-20-6-4-14-36-18-20/h1-14,17-18H,15-16H2,(H3,31,32)(H3,33,34)