N-methyl-4-[[methyl-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide

Systemtic Name: N-methyl-4-[[methyl-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide Openeye Name: 4-[[(4-allyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]methyl]-N-methyl-benzamide CAS Name: N-methyl-4-[[methyl-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide IUPAC Name: N-methyl-4-[[methyl-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide Traditional Name: 4-[[(4-allyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]methyl]-N-methyl-benzamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3=CC=CC=C3)CC=C

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3=CC=CC=C3)CC=C

InChI

InChI=1S/C22H25N5OS/c1-4-14-26-20(18-8-6-5-7-9-18)24-27(22(26)29)16-25(3)15-17-10-12-19(13-11-17)21(28)23-2/h4-13H,1,14-16H2,2-3H3,(H,23,28)