N-(4-acetamidophenyl)-2-[[5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[[5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-acetamidophenyl)-2-[(4-allyl-5-benzyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(4-acetamidophenyl)-2-[[5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[(5-benzyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-acetamidophenyl)-2-[(4-allyl-5-benzyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NN=C(N2CC=C)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NN=C(N2CC=C)CC3=CC=CC=C3

InChI

InChI=1S/C23H25N5O2S/c1-4-14-28-21(15-18-8-6-5-7-9-18)26-27-23(28)31-16(2)22(30)25-20-12-10-19(11-13-20)24-17(3)29/h4-13,16H,1,14-15H2,2-3H3,(H,24,29)(H,25,30)