decyl 2-[1-[[4-(2-methoxyethoxy)phenyl]carbonylcarbamothioyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: decyl 2-[1-[[4-(2-methoxyethoxy)phenyl]carbonylcarbamothioyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: decyl 2-[1-[[4-(2-methoxyethoxy)benzoyl]carbamothioyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[[[4-(2-methoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]-3-oxo-2-piperazinyl]acetic acid decyl ester IUPAC Name: decyl 2-[1-[[4-(2-methoxyethoxy)benzoyl]carbamothioyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[[4-(2-methoxyethoxy)benzoyl]thiocarbamoyl]piperazin-2-yl]acetic acid decyl ester Formula: C27H41N3O6S MolecularWeight: 535.69594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=S)NC(=O)C2=CC=C(C=C2)OCCOC

Isomeric SMILES

CCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=S)NC(=O)C2=CC=C(C=C2)OCCOC

InChI

InChI=1S/C27H41N3O6S/c1-3-4-5-6-7-8-9-10-17-36-24(31)20-23-26(33)28-15-16-30(23)27(37)29-25(32)21-11-13-22(14-12-21)35-19-18-34-2/h11-14,23H,3-10,15-20H2,1-2H3,(H,28,33)(H,29,32,37)