[2-[[3-(3-cyanophenyl)-3-oxidanylidene-propanoyl]amino]-4-thiophen-3-yl-phenyl]carbamic acid

Systemtic Name: [2-[[3-(3-cyanophenyl)-3-oxidanylidene-propanoyl]amino]-4-thiophen-3-yl-phenyl]carbamic acid Openeye Name: [2-[[3-(3-cyanophenyl)-3-oxo-propanoyl]amino]-4-(3-thienyl)phenyl]carbamic acid CAS Name: [2-[[3-(3-cyanophenyl)-1,3-dioxopropyl]amino]-4-(3-thiophenyl)phenyl]carbamic acid IUPAC Name: [2-[[3-(3-cyanophenyl)-3-oxopropanoyl]amino]-4-thiophen-3-ylphenyl]carbamic acid Traditional Name: [2-[[3-(3-cyanophenyl)-3-keto-propanoyl]amino]-4-(3-thienyl)phenyl]carbamic acid Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)C3=CSC=C3)NC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)C3=CSC=C3)NC(=O)O)C#N

InChI

InChI=1S/C21H15N3O4S/c22-11-13-2-1-3-15(8-13)19(25)10-20(26)23-18-9-14(16-6-7-29-12-16)4-5-17(18)24-21(27)28/h1-9,12,24H,10H2,(H,23,26)(H,27,28)