2-chloranyl-N-[3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[2-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]propyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[3-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[2-methyl-1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]propyl]-5-nitro-benzamide Formula: C20H19ClN4O4S MolecularWeight: 446.90726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C(C)C)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C(C)C)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H19ClN4O4S/c1-10(2)17(23-18(26)13-9-12(25(28)29)5-6-14(13)21)19(27)24-20-22-15-7-4-11(3)8-16(15)30-20/h4-10,17H,1-3H3,(H,23,26)(H,22,24,27)