5-(2-azanylpyridin-4-yl)-4-(4-methoxyphenyl)-2-[(phenylmethyl)amino]thiophene-3-carbonitrile

Systemtic Name: 5-(2-azanylpyridin-4-yl)-4-(4-methoxyphenyl)-2-[(phenylmethyl)amino]thiophene-3-carbonitrile Openeye Name: 5-(2-amino-4-pyridyl)-2-(benzylamino)-4-(4-methoxyphenyl)thiophene-3-carbonitrile CAS Name: 5-(2-amino-4-pyridinyl)-4-(4-methoxyphenyl)-2-[(phenylmethyl)amino]-3-thiophenecarbonitrile IUPAC Name: 5-(2-aminopyridin-4-yl)-2-(benzylamino)-4-(4-methoxyphenyl)thiophene-3-carbonitrile Traditional Name: 5-(2-amino-4-pyridyl)-2-(benzylamino)-4-(4-methoxyphenyl)thiophene-3-carbonitrile Formula: C24H20N4OS MolecularWeight: 412.5068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(SC(=C2C#N)NCC3=CC=CC=C3)C4=CC(=NC=C4)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(SC(=C2C#N)NCC3=CC=CC=C3)C4=CC(=NC=C4)N

InChI

InChI=1S/C24H20N4OS/c1-29-19-9-7-17(8-10-19)22-20(14-25)24(28-15-16-5-3-2-4-6-16)30-23(22)18-11-12-27-21(26)13-18/h2-13,28H,15H2,1H3,(H2,26,27)