N-[(E)-(6-methyl-4H-thiochromen-3-ylidene)amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(6-methyl-4H-thiochromen-3-ylidene)amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(6-methylthiochroman-3-ylidene)amino]-2,4-dinitro-aniline CAS Name: N-[(E)-(6-methyl-4H-1-benzothiopyran-3-ylidene)amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(6-methyl-4H-thiochromen-3-ylidene)amino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-(6-methylthiochroman-3-ylidene)amino]amine Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2

Isomeric SMILES

CC1=CC2=C(C=C1)SC/C(=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])/C2

InChI

InChI=1S/C16H14N4O4S/c1-10-2-5-16-11(6-10)7-12(9-25-16)17-18-14-4-3-13(19(21)22)8-15(14)20(23)24/h2-6,8,18H,7,9H2,1H3/b17-12+