4-azanyl-N-[4-[(1E)-1-[2-(methylamino)pyrrol-3-ylidene]ethyl]thiophen-2-yl]-2-phenyl-butanamide

Systemtic Name: 4-azanyl-N-[4-[(1E)-1-[2-(methylamino)pyrrol-3-ylidene]ethyl]thiophen-2-yl]-2-phenyl-butanamide Openeye Name: 4-amino-N-[4-[(1E)-1-[2-(methylamino)pyrrol-3-ylidene]ethyl]-2-thienyl]-2-phenyl-butanamide CAS Name: 4-amino-N-[4-[(1E)-1-[2-(methylamino)-3-pyrrolylidene]ethyl]-2-thiophenyl]-2-phenylbutanamide IUPAC Name: 4-amino-N-[4-[(1E)-1-[2-(methylamino)pyrrol-3-ylidene]ethyl]thiophen-2-yl]-2-phenylbutanamide Traditional Name: 4-amino-N-[4-[(1E)-1-[2-(methylamino)pyrrol-3-ylidene]ethyl]-2-thienyl]-2-phenyl-butyramide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CN=C1NC)C2=CSC(=C2)NC(=O)C(CCN)C3=CC=CC=C3

Isomeric SMILES

C/C(=C\1/C=CN=C1NC)/C2=CSC(=C2)NC(=O)C(CCN)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4OS/c1-14(17-9-11-24-20(17)23-2)16-12-19(27-13-16)25-21(26)18(8-10-22)15-6-4-3-5-7-15/h3-7,9,11-13,18H,8,10,22H2,1-2H3,(H,23,24)(H,25,26)/b17-14+