4-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 4-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 4-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]-6-methyl-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 4-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 4-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-6-methyl-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 4-[(Z)-[4-(azepan-1-yl)benzylidene]amino]-6-methyl-3-thioxo-2H-1,2,4-triazin-5-one Formula: C17H21N5OS MolecularWeight: 343.44654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)N=CC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC1=NNC(=S)N(C1=O)/N=C\C2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C17H21N5OS/c1-13-16(23)22(17(24)20-19-13)18-12-14-6-8-15(9-7-14)21-10-4-2-3-5-11-21/h6-9,12H,2-5,10-11H2,1H3,(H,20,24)/b18-12-