(6Z)-6-[3-azanyl-4-(1-propan-2-ylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]-4-ethyl-3-oxidanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[3-azanyl-4-(1-propan-2-ylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]-4-ethyl-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[3-amino-4-(1-isopropylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[3-amino-4-(1-propan-2-yl-4-indolyl)-1H-1,2,4-triazol-5-ylidene]-4-ethyl-3-hydroxy-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[3-amino-4-(1-propan-2-ylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]-4-ethyl-3-hydroxycyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[3-amino-4-(1-isopropylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2NN=C(N2C3=CC=CC4=C3C=CN4C(C)C)N)C(=O)C=C1O

Isomeric SMILES

CCC1=C/C(=C\2/NN=C(N2C3=CC=CC4=C3C=CN4C(C)C)N)/C(=O)C=C1O

InChI

InChI=1S/C21H23N5O2/c1-4-13-10-15(19(28)11-18(13)27)20-23-24-21(22)26(20)17-7-5-6-16-14(17)8-9-25(16)12(2)3/h5-12,23,27H,4H2,1-3H3,(H2,22,24)/b20-15+