2-naphthalen-1-ylethyl 2-[4-azanyl-5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: 2-naphthalen-1-ylethyl 2-[4-azanyl-5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]sulfanylethanoate Openeye Name: 2-(1-naphthyl)ethyl 2-[4-amino-5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-amino-5-[(4-fluoroanilino)-oxomethyl]-2-pyrimidinyl]thio]acetic acid 2-(1-naphthalenyl)ethyl ester IUPAC Name: 2-naphthalen-1-ylethyl 2-[4-amino-5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-amino-5-[(4-fluorophenyl)carbamoyl]pyrimidin-2-yl]thio]acetic acid 2-(1-naphthyl)ethyl ester Formula: C25H21FN4O3S MolecularWeight: 476.522643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CCOC(=O)CSC3=NC=C(C(=N3)N)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CCOC(=O)CSC3=NC=C(C(=N3)N)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C25H21FN4O3S/c26-18-8-10-19(11-9-18)29-24(32)21-14-28-25(30-23(21)27)34-15-22(31)33-13-12-17-6-3-5-16-4-1-2-7-20(16)17/h1-11,14H,12-13,15H2,(H,29,32)(H2,27,28,30)