methyl 3-azanyl-5-chloranyl-1-cyano-1-thiophen-3-yl-indene-2-carboxylate

Systemtic Name: methyl 3-azanyl-5-chloranyl-1-cyano-1-thiophen-3-yl-indene-2-carboxylate Openeye Name: methyl 3-amino-5-chloro-1-cyano-1-(3-thienyl)indene-2-carboxylate CAS Name: 3-amino-5-chloro-1-cyano-1-(3-thiophenyl)-2-indenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-5-chloro-1-cyano-1-thiophen-3-ylindene-2-carboxylate Traditional Name: 3-amino-5-chloro-1-cyano-1-(3-thienyl)indene-2-carboxylic acid methyl ester Formula: C16H11ClN2O2S MolecularWeight: 330.78874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C1(C#N)C3=CSC=C3)C=CC(=C2)Cl)N

Isomeric SMILES

COC(=O)C1=C(C2=C(C1(C#N)C3=CSC=C3)C=CC(=C2)Cl)N

InChI

InChI=1S/C16H11ClN2O2S/c1-21-15(20)13-14(19)11-6-10(17)2-3-12(11)16(13,8-18)9-4-5-22-7-9/h2-7H,19H2,1H3