ethyl 2-[2-oxidanylidene-2-[(4-phenylazanylphenyl)-propan-2-yl-amino]ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-2-[(4-phenylazanylphenyl)-propan-2-yl-amino]ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(4-anilino-N-isopropyl-anilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-anilino-N-isopropyl-anilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(C)C

Isomeric SMILES

CCOC(=O)CSCC(=O)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-26-21(25)15-27-14-20(24)23(16(2)3)19-12-10-18(11-13-19)22-17-8-6-5-7-9-17/h5-13,16,22H,4,14-15H2,1-3H3