ethyl 2-(1-azanyl-2-cyano-3-indol-3-ylidene-prop-1-enyl)sulfanylethanoate

Systemtic Name: ethyl 2-(1-azanyl-2-cyano-3-indol-3-ylidene-prop-1-enyl)sulfanylethanoate Openeye Name: ethyl 2-(1-amino-2-cyano-3-indol-3-ylidene-prop-1-enyl)sulfanylacetate CAS Name: 2-[[1-amino-2-cyano-3-(3-indolylidene)prop-1-enyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-amino-2-cyano-3-indol-3-ylideneprop-1-enyl)sulfanylacetate Traditional Name: 2-[(1-amino-2-cyano-3-indol-3-ylidene-prop-1-enyl)thio]acetic acid ethyl ester Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=C(C=C1C=NC2=CC=CC=C21)C#N)N

Isomeric SMILES

CCOC(=O)CSC(=C(C=C1C=NC2=CC=CC=C21)C#N)N

InChI

InChI=1S/C16H15N3O2S/c1-2-21-15(20)10-22-16(18)11(8-17)7-12-9-19-14-6-4-3-5-13(12)14/h3-7,9H,2,10,18H2,1H3