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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=S)N

Isomeric SMILES

CCOC(=O)CCCCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=S)N

InChI

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