methyl 3-[2-[bis(thiophen-2-ylmethyl)amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[bis(thiophen-2-ylmethyl)amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[bis(2-thienylmethyl)amino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[bis(thiophen-2-ylmethyl)amino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[bis(thiophen-2-ylmethyl)amino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[bis(2-thenyl)amino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(CC2=CC=CS2)CC3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(CC2=CC=CS2)CC3=CC=CS3

InChI

InChI=1S/C21H22N2O3S2/c1-15-7-8-16(21(25)26-2)11-19(15)22-20(24)14-23(12-17-5-3-9-27-17)13-18-6-4-10-28-18/h3-11H,12-14H2,1-2H3,(H,22,24)