1-[[2-(dimethylamino)pyridin-4-yl]methyl]-3-[(4-ethylphenyl)-thiophen-2-yl-methyl]urea

Systemtic Name: 1-[[2-(dimethylamino)pyridin-4-yl]methyl]-3-[(4-ethylphenyl)-thiophen-2-yl-methyl]urea Openeye Name: 1-[[2-(dimethylamino)-4-pyridyl]methyl]-3-[(4-ethylphenyl)-(2-thienyl)methyl]urea CAS Name: 1-[[2-(dimethylamino)-4-pyridinyl]methyl]-3-[(4-ethylphenyl)-thiophen-2-ylmethyl]urea IUPAC Name: 1-[[2-(dimethylamino)pyridin-4-yl]methyl]-3-[(4-ethylphenyl)-thiophen-2-ylmethyl]urea Traditional Name: 1-[[2-(dimethylamino)-4-pyridyl]methyl]-3-[(4-ethylphenyl)-(2-thienyl)methyl]urea Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)NCC3=CC(=NC=C3)N(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)NCC3=CC(=NC=C3)N(C)C

InChI

InChI=1S/C22H26N4OS/c1-4-16-7-9-18(10-8-16)21(19-6-5-13-28-19)25-22(27)24-15-17-11-12-23-20(14-17)26(2)3/h5-14,21H,4,15H2,1-3H3,(H2,24,25,27)