N-(3-azanylpropyl)-N-[(E)-2-methyl-3-phenyl-prop-2-enyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-(3-azanylpropyl)-N-[(E)-2-methyl-3-phenyl-prop-2-enyl]-4-thiophen-2-yl-butanamide Openeye Name: N-(3-aminopropyl)-N-[(E)-2-methyl-3-phenyl-allyl]-4-(2-thienyl)butanamide CAS Name: N-(3-aminopropyl)-N-[(E)-2-methyl-3-phenylprop-2-enyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-(3-aminopropyl)-N-[(E)-2-methyl-3-phenylprop-2-enyl]-4-thiophen-2-ylbutanamide Traditional Name: N-(3-aminopropyl)-N-[(E)-2-methyl-3-phenyl-allyl]-4-(2-thienyl)butyramide Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)CN(CCCN)C(=O)CCCC2=CC=CS2

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/CN(CCCN)C(=O)CCCC2=CC=CS2

InChI

InChI=1S/C21H28N2OS/c1-18(16-19-8-3-2-4-9-19)17-23(14-7-13-22)21(24)12-5-10-20-11-6-15-25-20/h2-4,6,8-9,11,15-16H,5,7,10,12-14,17,22H2,1H3/b18-16+