N-[4-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-3-methyl-butanamide Openeye Name: N-[4-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]phenyl]-3-methyl-butanamide CAS Name: N-[4-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-3-methylbutanamide IUPAC Name: N-[4-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-3-methylbutanamide Traditional Name: N-[4-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]phenyl]-3-methyl-butyramide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OC)C3=CC=CS3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OC)C3=CC=CS3

InChI

InChI=1S/C18H20N4O2S/c1-12(2)11-16(23)19-13-6-8-14(9-7-13)22-17(15-5-4-10-25-15)20-18(21-22)24-3/h4-10,12H,11H2,1-3H3,(H,19,23)