2-[3-[4-(pyrrol-1-ylmethyl)phenyl]thiophen-2-yl]oxane-4-carboxamide

Systemtic Name: 2-[3-[4-(pyrrol-1-ylmethyl)phenyl]thiophen-2-yl]oxane-4-carboxamide Openeye Name: 2-[3-[4-(pyrrol-1-ylmethyl)phenyl]-2-thienyl]tetrahydropyran-4-carboxamide CAS Name: 2-[3-[4-(1-pyrrolylmethyl)phenyl]-2-thiophenyl]-4-oxanecarboxamide IUPAC Name: 2-[3-[4-(pyrrol-1-ylmethyl)phenyl]thiophen-2-yl]oxane-4-carboxamide Traditional Name: 2-[3-[4-(pyrrol-1-ylmethyl)phenyl]-2-thienyl]tetrahydropyran-4-carboxamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CC1C(=O)N)C2=C(C=CS2)C3=CC=C(C=C3)CN4C=CC=C4

Isomeric SMILES

C1COC(CC1C(=O)N)C2=C(C=CS2)C3=CC=C(C=C3)CN4C=CC=C4

InChI

InChI=1S/C21H22N2O2S/c22-21(24)17-7-11-25-19(13-17)20-18(8-12-26-20)16-5-3-15(4-6-16)14-23-9-1-2-10-23/h1-6,8-10,12,17,19H,7,11,13-14H2,(H2,22,24)