4,5-dimethyl-2-[(3-piperidin-1-ylquinoxalin-2-yl)amino]thiophene-3-carbonitrile

Systemtic Name: 4,5-dimethyl-2-[(3-piperidin-1-ylquinoxalin-2-yl)amino]thiophene-3-carbonitrile Openeye Name: 4,5-dimethyl-2-[[3-(1-piperidyl)quinoxalin-2-yl]amino]thiophene-3-carbonitrile CAS Name: 4,5-dimethyl-2-[[3-(1-piperidinyl)-2-quinoxalinyl]amino]-3-thiophenecarbonitrile IUPAC Name: 4,5-dimethyl-2-[(3-piperidin-1-ylquinoxalin-2-yl)amino]thiophene-3-carbonitrile Traditional Name: 4,5-dimethyl-2-[(3-piperidinoquinoxalin-2-yl)amino]thiophene-3-carbonitrile Formula: C20H21N5S MolecularWeight: 363.47924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC2=NC3=CC=CC=C3N=C2N4CCCCC4)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC2=NC3=CC=CC=C3N=C2N4CCCCC4)C

InChI

InChI=1S/C20H21N5S/c1-13-14(2)26-20(15(13)12-21)24-18-19(25-10-6-3-7-11-25)23-17-9-5-4-8-16(17)22-18/h4-5,8-9H,3,6-7,10-11H2,1-2H3,(H,22,24)