2-cyanoethyl 3,3-dimethyl-5-(6-methyl-2-oxidanylidene-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-oxidanylidene-indole-1-carboxylate

Systemtic Name: 2-cyanoethyl 3,3-dimethyl-5-(6-methyl-2-oxidanylidene-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-oxidanylidene-indole-1-carboxylate Openeye Name: 2-cyanoethyl 3,3-dimethyl-5-(6-methyl-2-oxo-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-oxo-indoline-1-carboxylate CAS Name: 3,3-dimethyl-5-(6-methyl-2-oxo-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-oxo-1-indolecarboxylic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 3,3-dimethyl-5-(6-methyl-2-oxo-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-oxoindole-1-carboxylate Traditional Name: 2-keto-5-(2-keto-6-methyl-3,6-dihydro-1,3,4-thiadiazin-5-yl)-3,3-dimethyl-indoline-1-carboxylic acid 2-cyanoethyl ester Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NNC(=O)S1)C2=CC3=C(C=C2)N(C(=O)C3(C)C)C(=O)OCCC#N

Isomeric SMILES

CC1C(=NNC(=O)S1)C2=CC3=C(C=C2)N(C(=O)C3(C)C)C(=O)OCCC#N

InChI

InChI=1S/C18H18N4O4S/c1-10-14(20-21-16(24)27-10)11-5-6-13-12(9-11)18(2,3)15(23)22(13)17(25)26-8-4-7-19/h5-6,9-10H,4,8H2,1-3H3,(H,21,24)