N-(3-methoxypropyl)-2-[(4-nitrophenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(3-methoxypropyl)-2-[(4-nitrophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-methoxypropyl)-2-[(4-nitrobenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-methoxypropyl)-2-[[[[(4-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-methoxypropyl)-2-[(4-nitrobenzoyl)carbamothioylamino]benzamide Traditional Name: N-(3-methoxypropyl)-2-[(4-nitrobenzoyl)thiocarbamoylamino]benzamide Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5S/c1-28-12-4-11-20-18(25)15-5-2-3-6-16(15)21-19(29)22-17(24)13-7-9-14(10-8-13)23(26)27/h2-3,5-10H,4,11-12H2,1H3,(H,20,25)(H2,21,22,24,29)