N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-nitro-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-nitro-N-(oxolan-2-ylmethyl)benzamide Openeye Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-4-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-[2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-4-nitro-N-(2-oxolanylmethyl)benzamide IUPAC Name: N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-4-nitro-N-(oxolan-2-ylmethyl)benzamide Traditional Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-4-nitro-N-(tetrahydrofurfuryl)benzamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(CC3CCCO3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(CC3CCCO3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H29N3O5S/c1-20-9-14-25(36-20)18-28(16-21-6-3-2-4-7-21)26(31)19-29(17-24-8-5-15-35-24)27(32)22-10-12-23(13-11-22)30(33)34/h2-4,6-7,9-14,24H,5,8,15-19H2,1H3