ethyl 2-[4-[1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)ethylcarbamoylamino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[1-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)ethylcarbamoylamino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[1-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)ethylcarbamoylamino]phenyl]acetate CAS Name: 2-[4-[[[1-[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]ethylamino]-oxomethyl]amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[1-(4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)ethylcarbamoylamino]phenyl]acetate Traditional Name: 2-[4-[1-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)ethylcarbamoylamino]phenyl]acetic acid ethyl ester Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NC(C)C2=C(SC(=C2C)C)N3C=CC=C3

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)NC(=O)NC(C)C2=C(SC(=C2C)C)N3C=CC=C3

InChI

InChI=1S/C23H27N3O3S/c1-5-29-20(27)14-18-8-10-19(11-9-18)25-23(28)24-16(3)21-15(2)17(4)30-22(21)26-12-6-7-13-26/h6-13,16H,5,14H2,1-4H3,(H2,24,25,28)