(2S)-2-[2-azanylethanoyl-[[4-(2-methanoylhydrazinyl)phenyl]carbamothioyl]amino]-3-phenyl-propanamide

Systemtic Name: (2S)-2-[2-azanylethanoyl-[[4-(2-methanoylhydrazinyl)phenyl]carbamothioyl]amino]-3-phenyl-propanamide Openeye Name: (2S)-2-[(2-aminoacetyl)-[[4-(2-formylhydrazino)phenyl]carbamothioyl]amino]-3-phenyl-propanamide CAS Name: (2S)-2-[(2-amino-1-oxoethyl)-[[4-(formylhydrazo)anilino]-sulfanylidenemethyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-2-[(2-aminoacetyl)-[[4-(2-formylhydrazinyl)phenyl]carbamothioyl]amino]-3-phenylpropanamide Traditional Name: (2S)-2-[[4-(N'-formylhydrazino)phenyl]thiocarbamoyl-glycyl-amino]-3-phenyl-propionamide Formula: C19H22N6O3S MolecularWeight: 414.48138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)N(C(=O)CN)C(=S)NC2=CC=C(C=C2)NNC=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)N(C(=O)CN)C(=S)NC2=CC=C(C=C2)NNC=O

InChI

InChI=1S/C19H22N6O3S/c20-11-17(27)25(16(18(21)28)10-13-4-2-1-3-5-13)19(29)23-14-6-8-15(9-7-14)24-22-12-26/h1-9,12,16,24H,10-11,20H2,(H2,21,28)(H,22,26)(H,23,29)/t16-/m0/s1