N1,N3-bis[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]isophthalamide Formula: C30H32N6O4S2 MolecularWeight: 604.74288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)C(=O)NC3=C(C(=C(S3)C(=O)N(CC)CC)C)C#N)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)C(=O)NC3=C(C(=C(S3)C(=O)N(CC)CC)C)C#N)C#N)C

InChI

InChI=1S/C30H32N6O4S2/c1-7-35(8-2)29(39)23-17(5)21(15-31)27(41-23)33-25(37)19-12-11-13-20(14-19)26(38)34-28-22(16-32)18(6)24(42-28)30(40)36(9-3)10-4/h11-14H,7-10H2,1-6H3,(H,33,37)(H,34,38)