N-[[2-(dimethylamino)-5-(propan-2-ylcarbamoylamino)phenyl]methyl]-N-propyl-thiophene-2-carboxamide

Systemtic Name: N-[[2-(dimethylamino)-5-(propan-2-ylcarbamoylamino)phenyl]methyl]-N-propyl-thiophene-2-carboxamide Openeye Name: N-[[2-(dimethylamino)-5-(isopropylcarbamoylamino)phenyl]methyl]-N-propyl-thiophene-2-carboxamide CAS Name: N-[[2-(dimethylamino)-5-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-N-propyl-2-thiophenecarboxamide IUPAC Name: N-[[2-(dimethylamino)-5-(propan-2-ylcarbamoylamino)phenyl]methyl]-N-propylthiophene-2-carboxamide Traditional Name: N-[2-(dimethylamino)-5-(isopropylcarbamoylamino)benzyl]-N-propyl-thiophene-2-carboxamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=C(C=CC(=C1)NC(=O)NC(C)C)N(C)C)C(=O)C2=CC=CS2

Isomeric SMILES

CCCN(CC1=C(C=CC(=C1)NC(=O)NC(C)C)N(C)C)C(=O)C2=CC=CS2

InChI

InChI=1S/C21H30N4O2S/c1-6-11-25(20(26)19-8-7-12-28-19)14-16-13-17(9-10-18(16)24(4)5)23-21(27)22-15(2)3/h7-10,12-13,15H,6,11,14H2,1-5H3,(H2,22,23,27)