N-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C17H16ClN3O4S MolecularWeight: 393.84464

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O4S/c1-2-8-20(11-14-6-7-15(18)26-14)16(22)10-19-17(23)12-4-3-5-13(9-12)21(24)25/h2-7,9H,1,8,10-11H2,(H,19,23)