N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-9H-xanthene-9-carboxamide Openeye Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-9H-xanthene-9-carboxamide CAS Name: N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]-9H-xanthene-9-carboxamide Traditional Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-9H-xanthene-9-carboxamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C#N)C

InChI

InChI=1S/C25H23N3O3S/c1-4-28(5-2)25(30)22-15(3)18(14-26)24(32-22)27-23(29)21-16-10-6-8-12-19(16)31-20-13-9-7-11-17(20)21/h6-13,21H,4-5H2,1-3H3,(H,27,29)