N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-2-phenyl-N-prop-2-enyl-butanamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-2-phenyl-N-prop-2-enyl-butanamide Openeye Name: N-allyl-N-[2-[1,3-benzodioxol-5-ylmethyl(2-thienylmethyl)amino]-2-oxo-ethyl]-2-phenyl-butanamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-2-phenyl-N-prop-2-enylbutanamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-2-phenyl-N-prop-2-enylbutanamide Traditional Name: N-allyl-N-[2-keto-2-[piperonyl(2-thenyl)amino]ethyl]-2-phenyl-butyramide Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N(CC=C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N(CC=C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

InChI

InChI=1S/C28H30N2O4S/c1-3-14-29(28(32)24(4-2)22-9-6-5-7-10-22)19-27(31)30(18-23-11-8-15-35-23)17-21-12-13-25-26(16-21)34-20-33-25/h3,5-13,15-16,24H,1,4,14,17-20H2,2H3