ethyl (E)-4-[(2-naphthalen-1-ylethanoylamino)carbamothioylamino]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl (E)-4-[(2-naphthalen-1-ylethanoylamino)carbamothioylamino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[[[2-(1-naphthyl)acetyl]amino]carbamothioylamino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[[(2-naphthalen-1-ylacetyl)amino]carbamothioylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoylamino]but-2-enoic acid ethyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)NC(=S)NNC(=O)CC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CCOC(=O)/C=C/C(=O)NC(=S)NNC(=O)CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C19H19N3O4S/c1-2-26-18(25)11-10-16(23)20-19(27)22-21-17(24)12-14-8-5-7-13-6-3-4-9-15(13)14/h3-11H,2,12H2,1H3,(H,21,24)(H2,20,22,23,27)/b11-10+