ethyl 4,6-bis(chloranyl)-3-[(E)-3-[[4-[(ethylcarbamothioylamino)methyl]phenyl]amino]-3-oxidanylidene-prop-1-enyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 4,6-bis(chloranyl)-3-[(E)-3-[[4-[(ethylcarbamothioylamino)methyl]phenyl]amino]-3-oxidanylidene-prop-1-enyl]-1H-indole-2-carboxylate Openeye Name: ethyl 4,6-dichloro-3-[(E)-3-[4-[(ethylcarbamothioylamino)methyl]anilino]-3-oxo-prop-1-enyl]-1H-indole-2-carboxylate CAS Name: 4,6-dichloro-3-[(E)-3-[4-[[[ethylamino(sulfanylidene)methyl]amino]methyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4,6-dichloro-3-[(E)-3-[4-[(ethylcarbamothioylamino)methyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylate Traditional Name: 4,6-dichloro-3-[(E)-3-[4-[(ethylthiocarbamoylamino)methyl]anilino]-3-keto-prop-1-enyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C24H24Cl2N4O3S MolecularWeight: 519.44336

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC1=CC=C(C=C1)NC(=O)C=CC2=C(NC3=CC(=CC(=C32)Cl)Cl)C(=O)OCC

Isomeric SMILES

CCNC(=S)NCC1=CC=C(C=C1)NC(=O)/C=C/C2=C(NC3=CC(=CC(=C32)Cl)Cl)C(=O)OCC

InChI

InChI=1S/C24H24Cl2N4O3S/c1-3-27-24(34)28-13-14-5-7-16(8-6-14)29-20(31)10-9-17-21-18(26)11-15(25)12-19(21)30-22(17)23(32)33-4-2/h5-12,30H,3-4,13H2,1-2H3,(H,29,31)(H2,27,28,34)/b10-9+