2-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 2-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 2-[[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetyl]amino]-N-cyclopropyl-benzamide CAS Name: 2-[[2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 2-[[2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]acetyl]amino]-N-cyclopropylbenzamide Traditional Name: 2-[[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetyl]amino]-N-cyclopropyl-benzamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)CC(=O)NC2=CC=CC=C2C(=O)NC3CC3

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)CC(=O)NC2=CC=CC=C2C(=O)NC3CC3

InChI

InChI=1S/C20H22ClN3O2S/c1-2-11-24(12-15-9-10-18(21)27-15)13-19(25)23-17-6-4-3-5-16(17)20(26)22-14-7-8-14/h2-6,9-10,14H,1,7-8,11-13H2,(H,22,26)(H,23,25)