(4S)-2-azanyl-4-(5-nitrothiophen-2-yl)-5-oxidanylidene-1-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-4-(5-nitrothiophen-2-yl)-5-oxidanylidene-1-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (4S)-2-amino-4-(5-nitro-2-thienyl)-5-oxo-1-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: (4S)-2-amino-4-(5-nitro-2-thiophenyl)-5-oxo-1-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(5-nitrothiophen-2-yl)-5-oxo-1-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (4S)-2-amino-5-keto-4-(5-nitro-2-thienyl)-1-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C19H15N5O3S MolecularWeight: 393.4191

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=CN=CC=C3)N)C#N)C4=CC=C(S4)[N+](=O)[O-])C(=O)C1

Isomeric SMILES

C1CC2=C([C@H](C(=C(N2C3=CN=CC=C3)N)C#N)C4=CC=C(S4)[N+](=O)[O-])C(=O)C1

InChI

InChI=1S/C19H15N5O3S/c20-9-12-17(15-6-7-16(28-15)24(26)27)18-13(4-1-5-14(18)25)23(19(12)21)11-3-2-8-22-10-11/h2-3,6-8,10,17H,1,4-5,21H2/t17-/m1/s1