N-[1-[4-[2-(ethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[1-[4-[2-(ethylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[1-[4-[2-(ethylamino)-2-oxo-ethyl]piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: N-[1-[4-[2-(ethylamino)-2-oxoethyl]-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[1-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[1-[4-[2-(ethylamino)-2-keto-ethyl]piperazine-1-carbonyl]-3-(methylthio)propyl]-3-methyl-benzamide Formula: C21H32N4O3S MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN1CCN(CC1)C(=O)C(CCSC)NC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCNC(=O)CN1CCN(CC1)C(=O)C(CCSC)NC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C21H32N4O3S/c1-4-22-19(26)15-24-9-11-25(12-10-24)21(28)18(8-13-29-3)23-20(27)17-7-5-6-16(2)14-17/h5-7,14,18H,4,8-13,15H2,1-3H3,(H,22,26)(H,23,27)