N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-4-[(isopropylcarbamoylamino)methyl]benzamide CAS Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-4-[(isopropylcarbamoylamino)methyl]benzamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2S/c1-4-18-7-11-20(12-8-18)23(22-6-5-15-31-22)28-24(29)21-13-9-19(10-14-21)16-26-25(30)27-17(2)3/h5-15,17,23H,4,16H2,1-3H3,(H,28,29)(H2,26,27,30)