3-chloranyl-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-6-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-6-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(E)-[4-(diethylamino)phenyl]methyleneamino]-6-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-6-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-6-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(E)-[4-(diethylamino)benzylidene]amino]-6-methyl-benzothiophene-2-carboxamide Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=NNC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl

InChI

InChI=1S/C21H22ClN3OS/c1-4-25(5-2)16-9-7-15(8-10-16)13-23-24-21(26)20-19(22)17-11-6-14(3)12-18(17)27-20/h6-13H,4-5H2,1-3H3,(H,24,26)/b23-13+