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methyl 4-[prop-2-ynyl(quinoxalin-6-yloxycarbothioyl)amino]benzoate

methyl 4-[prop-2-ynyl(quinoxalin-6-yloxycarbothioyl)amino]benzoate

Systemtic Name:methyl 4-[prop-2-ynyl(quinoxalin-6-yloxycarbothioyl)amino]benzoate
Openeye Name:methyl 4-[prop-2-ynyl(quinoxalin-6-yloxycarbothioyl)amino]benzoate
CAS Name:4-[prop-2-ynyl-[6-quinoxalinyloxy(sulfanylidene)methyl]amino]benzoic acid methyl ester
IUPAC Name:methyl 4-[prop-2-ynyl(quinoxalin-6-yloxycarbothioyl)amino]benzoate
Traditional Name:4-[propargyl(quinoxalin-6-yloxycarbothioyl)amino]benzoic acid methyl ester
Formula: C20H15N3O3S
MolecularWeight: 377.4164
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N(CC#C)C(=S)OC2=CC3=NC=CN=C3C=C2


Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N(CC#C)C(=S)OC2=CC3=NC=CN=C3C=C2


InChI

InChI=1S/C20H15N3O3S/c1-3-12-23(15-6-4-14(5-7-15)19(24)25-2)20(27)26-16-8-9-17-18(13-16)22-11-10-21-17/h1,4-11,13H,12H2,2H3


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