6-azanyl-4-[[3-chloranyl-4-(thiophen-2-ylmethoxy)phenyl]amino]-7-ethoxy-quinoline-3-carbonitrile

Systemtic Name: 6-azanyl-4-[[3-chloranyl-4-(thiophen-2-ylmethoxy)phenyl]amino]-7-ethoxy-quinoline-3-carbonitrile Openeye Name: 6-amino-4-[3-chloro-4-(2-thienylmethoxy)anilino]-7-ethoxy-quinoline-3-carbonitrile CAS Name: 6-amino-4-[3-chloro-4-(thiophen-2-ylmethoxy)anilino]-7-ethoxy-3-quinolinecarbonitrile IUPAC Name: 6-amino-4-[3-chloro-4-(thiophen-2-ylmethoxy)anilino]-7-ethoxyquinoline-3-carbonitrile Traditional Name: 6-amino-4-[3-chloro-4-(2-thenyloxy)anilino]-7-ethoxy-quinoline-3-carbonitrile Formula: C23H19ClN4O2S MolecularWeight: 450.94056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CS4)Cl)C#N)N

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CS4)Cl)C#N)N

InChI

InChI=1S/C23H19ClN4O2S/c1-2-29-22-10-20-17(9-19(22)26)23(14(11-25)12-27-20)28-15-5-6-21(18(24)8-15)30-13-16-4-3-7-31-16/h3-10,12H,2,13,26H2,1H3,(H,27,28)