methyl 7-[(5-carbamothioyl-3-methyl-1H-indol-2-yl)carbonylamino]heptanoate

Systemtic Name: methyl 7-[(5-carbamothioyl-3-methyl-1H-indol-2-yl)carbonylamino]heptanoate Openeye Name: methyl 7-[(5-carbamothioyl-3-methyl-1H-indole-2-carbonyl)amino]heptanoate CAS Name: 7-[[(5-carbamothioyl-3-methyl-1H-indol-2-yl)-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[(5-carbamothioyl-3-methyl-1H-indole-2-carbonyl)amino]heptanoate Traditional Name: 7-[(3-methyl-5-thiocarbamoyl-1H-indole-2-carbonyl)amino]enanthic acid methyl ester Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=S)N)C(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=S)N)C(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C19H25N3O3S/c1-12-14-11-13(18(20)26)8-9-15(14)22-17(12)19(24)21-10-6-4-3-5-7-16(23)25-2/h8-9,11,22H,3-7,10H2,1-2H3,(H2,20,26)(H,21,24)