N-(3-methoxypropyl)-4-methyl-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-(3-methoxypropyl)-4-methyl-N-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-(3-methoxypropyl)-4-methyl-3-nitro-benzamide CAS Name: N-(3-methoxypropyl)-4-methyl-N-[2-[(3-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[benzyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-(3-methoxypropyl)-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-(3-methoxypropyl)-4-methyl-3-nitro-benzamide Formula: C27H31N3O5S MolecularWeight: 509.61714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCCOC)CC(=O)N(CC2=CC=CC=C2)CC3=C(C=CS3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCCOC)CC(=O)N(CC2=CC=CC=C2)CC3=C(C=CS3)C)[N+](=O)[O-]

InChI

InChI=1S/C27H31N3O5S/c1-20-10-11-23(16-24(20)30(33)34)27(32)28(13-7-14-35-3)19-26(31)29(17-22-8-5-4-6-9-22)18-25-21(2)12-15-36-25/h4-6,8-12,15-16H,7,13-14,17-19H2,1-3H3