phenyl-(5-phenyl-4-prop-2-enyl-3-sulfanylidene-2H-1,2,4-triazepin-7-yl)methanone

Systemtic Name: phenyl-(5-phenyl-4-prop-2-enyl-3-sulfanylidene-2H-1,2,4-triazepin-7-yl)methanone Openeye Name: (4-allyl-5-phenyl-3-thioxo-2H-1,2,4-triazepin-7-yl)-phenyl-methanone CAS Name: phenyl-(5-phenyl-4-prop-2-enyl-3-sulfanylidene-2H-1,2,4-triazepin-7-yl)methanone IUPAC Name: phenyl-(5-phenyl-4-prop-2-enyl-3-sulfanylidene-2H-1,2,4-triazepin-7-yl)methanone Traditional Name: (4-allyl-5-phenyl-3-thioxo-2H-1,2,4-triazepin-7-yl)-phenyl-methanone Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CC(=NNC1=S)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=CC(=NNC1=S)C(=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H17N3OS/c1-2-13-23-18(15-9-5-3-6-10-15)14-17(21-22-20(23)25)19(24)16-11-7-4-8-12-16/h2-12,14H,1,13H2,(H,22,25)